5-[1-(tert-butylcarbamoyl)pyrrolidin-2-yl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(tert-butylcarbamoyl)pyrrolidin-2-yl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
5-[1-(tert-butylcarbamoyl)pyrrolidin-2-yl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F793-0238 |
Compound Name: | 5-[1-(tert-butylcarbamoyl)pyrrolidin-2-yl]-N-(4-chlorophenyl)-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 407.92 |
Molecular Formula: | C18 H22 Cl N5 O2 S |
Smiles: | CC(C)(C)NC(N1CCCC1c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.4175 |
logD: | 3.4148 |
logSw: | -3.9384 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 72.509 |
InChI Key: | BICFWGBUPWZRSA-ZDUSSCGKSA-N |