N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-3-(trifluoromethyl)benzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-3-(trifluoromethyl)benzene-1-sulfonamide
N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-3-(trifluoromethyl)benzene-1-sulfonamide
Compound characteristics
Compound ID: | M071-0160 |
Compound Name: | N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-3-(trifluoromethyl)benzene-1-sulfonamide |
Molecular Weight: | 436.45 |
Molecular Formula: | C15 H11 F3 N2 O4 S3 |
Smiles: | CS(c1nc2ccc(cc2s1)NS(c1cccc(c1)C(F)(F)F)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.2869 |
logD: | 2.9572 |
logSw: | -3.7696 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.132 |
InChI Key: | IOIJXYCXDRQZCW-UHFFFAOYSA-N |