Chemical ID: 5930662

Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3ccccc3OC(=O)C(c4ccccc4)c5ccccc5
Chemical ID:
5930662
Name [?]:
[2-[4-methyl-9-(1,1,3,3-tetramethylbutylamino)-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-8-yl]phenyl] 2,2-diphenylacetate
SMILES [?]:
Cc1ccn2c(c1)nc(c2NC(C)(C)CC(C)(C)C)c3ccccc3OC(=O)C(c4ccccc4)c5ccccc5
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C36H39N3O2
All Atoms:41
Heavy Atoms:41
Chiral Atoms:0
ZAP Information [?]
Total:15.4113
Area:740.25
Solvation:-3.09496
Coulombic:-48.066
Bond Count [?]
All:45
Single:31
Double:14
Rotors:10
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:545.714
H-Bond Donors:1
H-Bond Acceptors:3
XLogP:9.76
LogP (Chemaxon):8.99

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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