2-methyl-N-{5-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
Chemical Structure Depiction of
2-methyl-N-{5-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
2-methyl-N-{5-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide
Compound characteristics
Compound ID: | L264-0731 |
Compound Name: | 2-methyl-N-{5-[(4-methylbenzene-1-sulfonyl)amino]-1,3-benzothiazol-2-yl}propanamide |
Molecular Weight: | 389.49 |
Molecular Formula: | C18 H19 N3 O3 S2 |
Smiles: | [H]c1cc2c(cc1NS(c1ccc(C)cc1)(=O)=O)nc(NC(C(C)C)=O)s2 |
Stereo: | ACHIRAL |
logP: | 4.6509 |
logD: | 4.068 |
logSw: | -4.4183 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.012 |
InChI Key: | BVXADZJTBCGUOS-UHFFFAOYSA-N |