5-chloro-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
Chemical Structure Depiction of
5-chloro-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
5-chloro-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide
Compound characteristics
Compound ID: | M071-0461 |
Compound Name: | 5-chloro-N-[2-(propane-1-sulfonyl)-1,3-benzothiazol-6-yl]thiophene-2-sulfonamide |
Molecular Weight: | 436.97 |
Molecular Formula: | C14 H13 Cl N2 O4 S4 |
Smiles: | CCCS(c1nc2ccc(cc2s1)NS(c1ccc(s1)[Cl])(=O)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 4.2036 |
logD: | 4.0934 |
logSw: | -4.4013 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.438 |
InChI Key: | WVKQXOZHFSQXGV-UHFFFAOYSA-N |