3-chloro-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
3-chloro-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
Compound characteristics
Compound ID: | M071-0233 |
Compound Name: | 3-chloro-N-[2-(methanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide |
Molecular Weight: | 432.92 |
Molecular Formula: | C15 H13 Cl N2 O5 S3 |
Smiles: | COc1ccc(cc1[Cl])S(Nc1ccc2c(c1)sc(n2)S(C)(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 2.7402 |
logD: | 2.694 |
logSw: | -3.5673 |
Hydrogen bond acceptors count: | 10 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 87.763 |
InChI Key: | XOODZIDOQQIFOK-UHFFFAOYSA-N |