4-tert-butyl-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]benzamide
Chemical Structure Depiction of
4-tert-butyl-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]benzamide
4-tert-butyl-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]benzamide
Compound characteristics
Compound ID: | Y032-1591 |
Compound Name: | 4-tert-butyl-N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]benzamide |
Molecular Weight: | 388.51 |
Molecular Formula: | C19 H20 N2 O3 S2 |
Smiles: | CC(C)(C)c1ccc(cc1)C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 4.3701 |
logD: | 4.3635 |
logSw: | -4.2999 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 62.84 |
InChI Key: | QIQBZNKRLJBPHS-UHFFFAOYSA-N |