5-[1-(5-bromofuran-2-carbonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(5-bromofuran-2-carbonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(5-bromofuran-2-carbonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F792-0519 |
Compound Name: | 5-[1-(5-bromofuran-2-carbonyl)pyrrolidin-2-yl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 461.34 |
Molecular Formula: | C19 H17 Br N4 O3 S |
Smiles: | Cc1ccc(cc1)NC(c1nnc(C2CCCN2C(c2ccc(o2)[Br])=O)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4819 |
logD: | 3.4818 |
logSw: | -3.6437 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 72.196 |
InChI Key: | KALFSEVPBHGQJO-ZDUSSCGKSA-N |