Chemical ID: 5966584

Cc1ccc(cc1)C2c3ccsc3CCN2S(=O)(=O)c4ccc(cc4)C
Chemical ID:
5966584
Name [?]:
2-(p-tolyl)-3-(p-tolylsulfonyl)-7-thia-3-azabicyclo[4.3.0]nona-8,10-diene
SMILES [?]:
Cc1ccc(cc1)C2c3ccsc3CCN2S(=O)(=O)c4ccc(cc4)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C21H21NO2S2
All Atoms:26
Heavy Atoms:26
Chiral Atoms:2
ZAP Information [?]
Total:11.3019
Area:548.96
Solvation:-2.42215
Coulombic:-10.5599
Bond Count [?]
All:29
Single:19
Double:10
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:383.529
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.09
LogP (Chemaxon):4.93

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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