5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F794-1131 |
Compound Name: | 5-[1-(4-ethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(2-fluorophenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 460.55 |
Molecular Formula: | C21 H21 F N4 O3 S2 |
Smiles: | CCc1ccc(cc1)S(N1CCCC1c1nnc(C(Nc2ccccc2F)=O)s1)(=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.9381 |
logD: | 3.9334 |
logSw: | -3.7788 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 78.412 |
InChI Key: | GQQJEVWCTCXUQP-SFHVURJKSA-N |