Chemical ID: 6750876

C=C1C(C(n2c(nc(n2)c3ccc(cc3)Cl)N1)c4cccnc4)C(=O)N
Chemical ID:
6750876
Name [?]:
8-(4-chlorophenyl)-4-methylene-2-(3-pyridyl)-1,5,7,9-tetrazabicyclo[4.3.0]nona-6,8-diene-3-carboxamide
SMILES [?]:
C=C1C(C(n2c(nc(n2)c3ccc(cc3)Cl)N1)c4cccnc4)C(=O)N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H15ClN6O
All Atoms:41
Heavy Atoms:26
Chiral Atoms:2
ZAP Information [?]
Total:10.6326
Area:553.081
Solvation:-3.19437
Coulombic:-55.4908
Bond Count [?]
All:29
Single:19
Double:10
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:366.804
H-Bond Donors:3
H-Bond Acceptors:3
XLogP:2.45
LogP (Chemaxon):1.58

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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