Chemical ID: 3981922

CCC(C)C1(C2C(C(N1)c3cc(ccc3OC)Br)C(=O)N(C2=O)C4CCCCC4)C(=O)O
Chemical ID:
3981922
Name [?]:
6-(5-bromo-2-methoxy-phenyl)-3-cyclohexyl-2,4-dioxo-8-sec-butyl-3,7-diazabicyclo[3.3.0]octane-8-carboxylic acid
SMILES [?]:
CCC(C)C1(C2C(C(N1)c3cc(ccc3OC)Br)C(=O)N(C2=O)C4CCCCC4)C(=O)O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C24H31BrN2O5
All Atoms:32
Heavy Atoms:32
Chiral Atoms:5
ZAP Information [?]
Total:9.85859
Area:587.62
Solvation:-4.8319
Coulombic:-67.6402
Bond Count [?]
All:35
Single:29
Double:6
Rotors:6
Chiral:0
Rigid Segments:7
Chemical Properties
Molecular Weight:507.417
H-Bond Donors:2
H-Bond Acceptors:7
XLogP:3.49
LogP (Chemaxon):1.34

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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