N-(4-chlorophenyl)-5-{1-[(4-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-{1-[(4-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide
N-(4-chlorophenyl)-5-{1-[(4-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
Compound ID: | F793-0187 |
Compound Name: | N-(4-chlorophenyl)-5-{1-[(4-methoxyphenyl)carbamoyl]pyrrolidin-2-yl}-1,3,4-thiadiazole-2-carboxamide |
Molecular Weight: | 457.94 |
Molecular Formula: | C21 H20 Cl N5 O3 S |
Smiles: | COc1ccc(cc1)NC(N1CCCC1c1nnc(C(Nc2ccc(cc2)[Cl])=O)s1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 3.7337 |
logD: | 3.731 |
logSw: | -4.4095 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 2 |
Polar surface area: | 79.635 |
InChI Key: | XCPMLJWPBIRZCK-KRWDZBQOSA-N |