Chemical ID: 5812161

CCCC1(C2C(C(N1)c3ccc(cc3O)OC)C(=O)N(C2=O)c4cccc5c4cccc5)C(=O)O
Chemical ID:
5812161
Name [?]:
6-(2-hydroxy-4-methoxy-phenyl)-3-(1-naphthyl)-2,4-dioxo-8-propyl-3,7-diazabicyclo[3.3.0]octane-8-carboxylic acid
SMILES [?]:
CCCC1(C2C(C(N1)c3ccc(cc3O)OC)C(=O)N(C2=O)c4cccc5c4cccc5)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C27H26N2O6
All Atoms:35
Heavy Atoms:35
Chiral Atoms:4
ZAP Information [?]
Total:7.64177
Area:584.793
Solvation:-6.97806
Coulombic:-82.4944
Bond Count [?]
All:39
Single:28
Double:11
Rotors:6
Chiral:0
Rigid Segments:6
Chemical Properties
Molecular Weight:474.505
H-Bond Donors:3
H-Bond Acceptors:8
XLogP:2.99
LogP (Chemaxon):0.96

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue