5-[1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
5-[1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F792-0635 |
| Compound Name: | 5-[1-(3,5-dimethoxybenzoyl)pyrrolidin-2-yl]-N-phenyl-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | COc1cc(cc(c1)OC)C(N1CCCC1c1nnc(C(Nc2ccccc2)=O)s1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.001 |
| logD: | 3.001 |
| logSw: | -3.5624 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.358 |
| InChI Key: | BOCONZRRWJOOTB-SFHVURJKSA-N |