5-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0871 |
| Compound Name: | 5-({2-[(3-methylbutyl)amino]-2-oxoethyl}sulfanyl)-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 378.51 |
| Molecular Formula: | C17 H22 N4 O2 S2 |
| Smiles: | CC(C)CCNC(CSc1nnc(C(Nc2ccc(C)cc2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4455 |
| logD: | 3.4454 |
| logSw: | -3.6308 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.508 |
| InChI Key: | BJYIBEHITQIIMS-UHFFFAOYSA-N |