2,6-Piperidinedione, 3-[6-[7-[[1-[[4-[6-(1-azetidinyl)-1,2-dihydro-2-methyl-1...
C47H56N8O6
2676211-64-4 Copyright (C) 2024 ACS
  0  0  0     0  0            999 V3000
M  V30 BEGIN CTAB
M  V30 COUNTS  61 70 0 0 1
M  V30 BEGIN ATOM
M  V30 1 C 14.6706 3.8500 0.0 0
M  V30 2 O 26.4993 6.0786 0.0 0
M  V30 3 C 9.3359 6.9301 0.0 0
M  V30 4 O 28.4687 11.4565 0.0 0
M  V30 5 O 33.0888 8.7890 0.0 0
M  V30 6 O 6.6684 8.4701 0.0 0
M  V30 7 C 8.0021 9.2401 0.0 0
M  V30 8 O 9.3359 3.8500 0.0 0
M  V30 9 C 9.3359 2.3100 0.0 0
M  V30 10 C 2.6673 0.0000 0.0 0
M  V30 11 O 0.0000 1.5400 0.0 0
M  V30 12 C 18.6716 6.1601 0.0 0
M  V30 13 C 19.0703 7.6476 0.0 0
M  V30 14 C 20.1593 5.7615 0.0 0
M  V30 15 C 18.6716 4.6200 0.0 0
M  V30 16 C 17.3379 6.9301 0.0 0
M  V30 17 N 20.5578 7.2490 0.0 0
M  V30 18 C 17.3379 3.8500 0.0 0
M  V30 19 C 16.0043 6.1601 0.0 0
M  V30 20 N 16.0043 4.6200 0.0 0
M  V30 21 C 21.8915 8.0190 0.0 0
M  V30 22 C 23.2251 7.2490 0.0 0
M  V30 23 C 21.8915 9.5590 0.0 0
M  V30 24 C 24.5589 8.0190 0.0 0
M  V30 25 C 23.2251 10.3290 0.0 0
M  V30 26 C 24.5589 9.5590 0.0 0
M  V30 27 C 26.0235 7.5431 0.0 0
M  V30 28 C 26.0235 10.0349 0.0 0
M  V30 29 N 26.9287 8.7890 0.0 0
M  V30 30 C 13.3368 4.6200 0.0 0
M  V30 31 C 13.3368 6.1601 0.0 0
M  V30 32 C 12.0032 3.8500 0.0 0
M  V30 33 C 12.0032 6.9301 0.0 0
M  V30 34 C 10.6695 4.6200 0.0 0
M  V30 35 N 10.6695 6.1601 0.0 0
M  V30 36 C 28.4687 8.7890 0.0 0 CFG=1
M  V30 37 C 29.2387 10.1228 0.0 0
M  V30 38 C 29.2387 7.4554 0.0 0
M  V30 39 N 30.7787 10.1228 0.0 0
M  V30 40 C 30.7787 7.4554 0.0 0
M  V30 41 C 31.5487 8.7890 0.0 0
M  V30 42 C 8.0021 6.1601 0.0 0
M  V30 43 C 6.6684 6.9301 0.0 0
M  V30 44 C 8.0021 4.6200 0.0 0
M  V30 45 C 5.3348 6.1601 0.0 0
M  V30 46 C 6.6684 3.8500 0.0 0
M  V30 47 C 5.3348 4.6200 0.0 0
M  V30 48 C 4.0011 3.8500 0.0 0
M  V30 49 C 2.6673 4.6200 0.0 0
M  V30 50 C 4.0011 2.3100 0.0 0
M  V30 51 C 1.3337 3.8500 0.0 0
M  V30 52 C 2.6673 6.1601 0.0 0
M  V30 53 N 2.6673 1.5400 0.0 0
M  V30 54 C 0.0000 4.6200 0.0 0
M  V30 55 C 1.3337 2.3100 0.0 0
M  V30 56 C 1.3337 6.9301 0.0 0
M  V30 57 N 0.0000 6.1601 0.0 0
M  V30 58 N 1.3337 8.4701 0.0 0
M  V30 59 C 2.4226 9.5590 0.0 0
M  V30 60 C 0.2447 9.5590 0.0 0
M  V30 61 C 1.3337 10.6480 0.0 0
M  V30 END ATOM
M  V30 BEGIN BOND
M  V30 1 1 1 20
M  V30 2 1 1 30
M  V30 3 2 2 27
M  V30 4 1 3 35
M  V30 5 1 3 42
M  V30 6 2 4 37
M  V30 7 2 5 41
M  V30 8 1 6 7
M  V30 9 1 6 43
M  V30 10 1 8 9
M  V30 11 1 8 44
M  V30 12 1 10 53
M  V30 13 2 11 55
M  V30 14 1 12 13
M  V30 15 1 12 14
M  V30 16 1 12 15
M  V30 17 1 12 16
M  V30 18 1 13 17
M  V30 19 1 14 17
M  V30 20 1 15 18
M  V30 21 1 16 19
M  V30 22 1 17 21
M  V30 23 1 18 20
M  V30 24 1 19 20
M  V30 25 1 21 22
M  V30 26 2 21 23
M  V30 27 2 22 24
M  V30 28 1 23 25
M  V30 29 1 24 26
M  V30 30 1 24 27
M  V30 31 2 25 26
M  V30 32 1 26 28
M  V30 33 1 27 29
M  V30 34 1 28 29
M  V30 35 1 36 29 CFG=3
M  V30 36 1 30 31
M  V30 37 1 30 32
M  V30 38 1 31 33
M  V30 39 1 32 34
M  V30 40 1 33 35
M  V30 41 1 34 35
M  V30 42 1 36 37
M  V30 43 1 36 38
M  V30 44 1 37 39
M  V30 45 1 38 40
M  V30 46 1 39 41
M  V30 47 1 40 41
M  V30 48 2 42 43
M  V30 49 1 42 44
M  V30 50 1 43 45
M  V30 51 2 44 46
M  V30 52 2 45 47
M  V30 53 1 46 47
M  V30 54 1 47 48
M  V30 55 1 48 49
M  V30 56 2 48 50
M  V30 57 1 49 51
M  V30 58 2 49 52
M  V30 59 1 50 53
M  V30 60 2 51 54
M  V30 61 1 51 55
M  V30 62 1 52 56
M  V30 63 1 53 55
M  V30 64 1 54 57
M  V30 65 2 56 57
M  V30 66 1 56 58
M  V30 67 1 58 59
M  V30 68 1 58 60
M  V30 69 1 59 61
M  V30 70 1 60 61
M  V30 END BOND
M  V30 BEGIN COLLECTION
M  V30 MDLV30/STEABS ATOMS=(1 36)
M  V30 END COLLECTION
M  V30 END CTAB
M  END
> <cas.rn>
2676211-64-4

> <cas.index.name>
2,6-Piperidinedione, 3-[6-[7-[[1-[[4-[6-(1-azetidinyl)-1,2-dihydro-2-methyl-1-oxo-2,7-naphthyridin-4-yl]-2,6-dimethoxyphenyl]methyl]-4-piperidinyl]methyl]-2,7-diazaspiro[3.5]non-2-yl]-1,3-dihydro-1-oxo-2H-isoindol-2-yl]-, (3S)-

> <molecular.formula>
C47H56N8O6

> <molecular.weight>
829.00

> <density.predicted>
1.40±0.1 g/cm3    Temp: 20 °C; Press: 760 Torr

> <pka.predicted>
10.75±0.40    Most Acidic Temp: 25 °C

$$$$
