5-[1-(4-acetylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(4-acetylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(4-acetylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F794-1042 |
Compound Name: | 5-[1-(4-acetylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2,4-difluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 492.52 |
Molecular Formula: | C21 H18 F2 N4 O4 S2 |
Smiles: | CC(c1ccc(cc1)S(N1CCCC1c1nnc(C(Nc2ccc(cc2F)F)=O)s1)(=O)=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.6853 |
logD: | 2.46 |
logSw: | -3.2305 |
Hydrogen bond acceptors count: | 11 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 92.239 |
InChI Key: | HBMJTKZGDLOWQD-SFHVURJKSA-N |