Chemical ID: 3973107

CCCCN1C(=O)C2C(NC(C2C1=O)(C(C)C)C(=O)O)c3ccc(cc3)c4ccccc4
Chemical ID:
3973107
Name [?]:
7-butyl-4-isopropyl-6,8-dioxo-2-(4-phenylphenyl)-3,7-diazabicyclo[3.3.0]octane-4-carboxylic acid
SMILES [?]:
CCCCN1C(=O)C2C(NC(C2C1=O)(C(C)C)C(=O)O)c3ccc(cc3)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C26H30N2O4
All Atoms:32
Heavy Atoms:32
Chiral Atoms:4
ZAP Information [?]
Total:12.0923
Area:650.124
Solvation:-4.16078
Coulombic:-62.5625
Bond Count [?]
All:35
Single:26
Double:9
Rotors:7
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:434.527
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.67
LogP (Chemaxon):1.71

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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