Chemical ID: 5930318

CC(CC(=O)Oc1ccccc1c2c(n3ccccc3n2)NC(C)(C)CC(C)(C)C)CC(C)(C)C
Chemical ID:
5930318
Name [?]:
[2-[9-(1,1,3,3-tetramethylbutylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 3,5,5-trimethylhexanoate
SMILES [?]:
CC(CC(=O)Oc1ccccc1c2c(n3ccccc3n2)NC(C)(C)CC(C)(C)C)CC(C)(C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H43N3O2
All Atoms:35
Heavy Atoms:35
Chiral Atoms:1
ZAP Information [?]
Total:14.9537
Area:693.284
Solvation:-2.37838
Coulombic:-45.8257
Bond Count [?]
All:37
Single:29
Double:8
Rotors:11
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:477.681
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:9.79
LogP (Chemaxon):7.81

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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