Chemical ID: 5294455

c1ccc(cc1)NC(=O)N2C3CCCCC3N=C2NC(=O)c4ccc(cc4)Cl
Chemical ID:
5294455
Name [?]:
2-(4-chlorobenzoyl)amino-N-phenyl-3a,4,5,6,7,7a-hexahydrobenzoimidazole-1-carboxamide
SMILES [?]:
c1ccc(cc1)NC(=O)N2C3CCCCC3N=C2NC(=O)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21ClN4O2
All Atoms:28
Heavy Atoms:28
Chiral Atoms:2
ZAP Information [?]
Total:11.263
Area:590.993
Solvation:-3.5118
Coulombic:-58.6867
Bond Count [?]
All:31
Single:22
Double:9
Rotors:6
Chiral:0
Rigid Segments:5
Chemical Properties
Molecular Weight:396.87
H-Bond Donors:2
H-Bond Acceptors:6
XLogP:4.57
LogP (Chemaxon):4.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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