N-(3-chloro-4-fluorophenyl)-N~2~-(2-methyl-1,3-benzothiazole-6-sulfonyl)glycinamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-N~2~-(2-methyl-1,3-benzothiazole-6-sulfonyl)glycinamide
N-(3-chloro-4-fluorophenyl)-N~2~-(2-methyl-1,3-benzothiazole-6-sulfonyl)glycinamide
Compound characteristics
Compound ID: | C920-1669 |
Compound Name: | N-(3-chloro-4-fluorophenyl)-N~2~-(2-methyl-1,3-benzothiazole-6-sulfonyl)glycinamide |
Molecular Weight: | 413.87 |
Molecular Formula: | C16 H13 Cl F N3 O3 S2 |
Smiles: | Cc1nc2ccc(cc2s1)S(NCC(Nc1ccc(c(c1)[Cl])F)=O)(=O)=O |
Stereo: | ACHIRAL |
logP: | 3.6038 |
logD: | 3.5571 |
logSw: | -3.8531 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 74.673 |
InChI Key: | GTNVGFXAGNSSPY-UHFFFAOYSA-N |