Chemical ID: 4881664

Cc1ccc(cc1)c2nnc3n2N=C(CS3)c4ccc(cc4)Cl
Chemical ID:
4881664
Name [?]:
4-(4-chlorophenyl)-7-(p-tolyl)-2-thia-5,6,8,9-tetrazabicyclo[4.3.0]nona-4,7,9-triene
SMILES [?]:
Cc1ccc(cc1)c2nnc3n2N=C(CS3)c4ccc(cc4)Cl
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H13ClN4S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.5321
Area:525.371
Solvation:-1.60219
Coulombic:-14.8118
Bond Count [?]
All:26
Single:17
Double:9
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:340.831
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.08
LogP (Chemaxon):4.31

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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