Chemical ID: 5930606

Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3cccc(c3)OC(=O)c4cccc(c4)C(F)(F)F
Chemical ID:
5930606
Name [?]:
[3-[4-methyl-9-(1,1,3,3-tetramethylbutylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 3-(trifluoromethyl)benzoate
SMILES [?]:
Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3cccc(c3)OC(=O)c4cccc(c4)C(F)(F)F
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C30H32F3N3O2
All Atoms:38
Heavy Atoms:38
Chiral Atoms:0
ZAP Information [?]
Total:14.7547
Area:717.142
Solvation:-3.17383
Coulombic:-64.9383
Bond Count [?]
All:41
Single:30
Double:11
Rotors:9
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:523.589
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:9.2
LogP (Chemaxon):7.98

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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