Chemical ID: 3972776

CCN1C(=O)C2C(NC(C2C1=O)(CC(C)C)C(=O)O)c3ccc(cc3)c4ccccc4
Chemical ID:
3972776
Name [?]:
7-ethyl-4-isobutyl-6,8-dioxo-2-(4-phenylphenyl)-3,7-diazabicyclo[3.3.0]octane-4-carboxylic acid
SMILES [?]:
CCN1C(=O)C2C(NC(C2C1=O)(CC(C)C)C(=O)O)c3ccc(cc3)c4ccccc4
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C25H28N2O4
All Atoms:31
Heavy Atoms:31
Chiral Atoms:4
ZAP Information [?]
Total:11.2663
Area:619.811
Solvation:-4.22898
Coulombic:-61.9604
Bond Count [?]
All:34
Single:25
Double:9
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:420.501
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:3.52
LogP (Chemaxon):1.17

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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