5-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | G713-0040 |
| Compound Name: | 5-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 410.49 |
| Molecular Formula: | C21 H22 N4 O3 S |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(CCC(Nc2cc(C)ccc2OC)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1774 |
| logD: | 3.1774 |
| logSw: | -3.4718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.139 |
| InChI Key: | HLLCGMUXISHWNS-UHFFFAOYSA-N |