4-acetyl-N-(4-bromophenyl)-N-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-(4-bromophenyl)-N-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-(4-bromophenyl)-N-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
Compound ID: | E459-0389 |
Compound Name: | 4-acetyl-N-(4-bromophenyl)-N-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
Molecular Weight: | 441.36 |
Molecular Formula: | C17 H17 Br N2 O3 S2 |
Smiles: | CC(N1CCSc2ccc(cc12)S(N(C)c1ccc(cc1)[Br])(=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8386 |
logD: | 3.8386 |
logSw: | -3.9496 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 49.112 |
InChI Key: | MXYUIYDWDNMGSN-UHFFFAOYSA-N |