Chemical ID: 4807299

Cc1cccc(c1)c2nnc3n2N=C(CS3)c4ccccc4C
Chemical ID:
4807299
Name [?]:
7-(m-tolyl)-4-(o-tolyl)-2-thia-5,6,8,9-tetrazabicyclo[4.3.0]nona-4,7,9-triene
SMILES [?]:
Cc1cccc(c1)c2nnc3n2N=C(CS3)c4ccccc4C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C18H16N4S
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:11.2923
Area:512.64
Solvation:-1.52372
Coulombic:-14.7794
Bond Count [?]
All:26
Single:17
Double:9
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:320.413
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:5.9
LogP (Chemaxon):4.26

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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