Chemical ID: 4324413

c1ccc(cc1)c2c(n3cc(ccc3n2)Cl)NC(=O)c4ccc(cc4)Cl
Chemical ID:
4324413
Name [?]:
4-chloro-N-(3-chloro-8-phenyl-1,7-diazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl)-benzamide
SMILES [?]:
c1ccc(cc1)c2c(n3cc(ccc3n2)Cl)NC(=O)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C20H13Cl2N3O
All Atoms:26
Heavy Atoms:26
Chiral Atoms:0
ZAP Information [?]
Total:11.791
Area:575.399
Solvation:-2.59398
Coulombic:-36.4977
Bond Count [?]
All:29
Single:18
Double:11
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:382.242
H-Bond Donors:1
H-Bond Acceptors:2
XLogP:5.57
LogP (Chemaxon):5.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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