Chemical ID: 4702650

Cc1c(c(n2c(n1)nnn2)C)Cc3ccc(cc3)Cl
Chemical ID:
4702650
Name [?]:
3-[(4-chlorophenyl)methyl]-2,4-dimethyl-1,5,7,8,9-pentazabicyclo[4.3.0]nona-2,4,6,8-tetraene
SMILES [?]:
Cc1c(c(n2c(n1)nnn2)C)Cc3ccc(cc3)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H12ClN5
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:9.54433
Area:436.754
Solvation:-1.37453
Coulombic:-13.6017
Bond Count [?]
All:21
Single:14
Double:7
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:273.721
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:1.41
LogP (Chemaxon):3.05

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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