5-[1-(2,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(2,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(2,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F794-0329 |
Compound Name: | 5-[1-(2,4-dimethylbenzene-1-sulfonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 456.58 |
Molecular Formula: | C22 H24 N4 O3 S2 |
Smiles: | Cc1ccc(cc1)NC(c1nnc(C2CCCN2S(c2ccc(C)cc2C)(=O)=O)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 4.3271 |
logD: | 4.327 |
logSw: | -4.1329 |
Hydrogen bond acceptors count: | 9 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 79.11 |
InChI Key: | AKQTXHYFVQTSPI-SFHVURJKSA-N |