5-[(2-{[(3-bromophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
5-[(2-{[(3-bromophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
5-[(2-{[(3-bromophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | F736-0983 |
| Compound Name: | 5-[(2-{[(3-bromophenyl)methyl]amino}-2-oxoethyl)sulfanyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 477.4 |
| Molecular Formula: | C19 H17 Br N4 O2 S2 |
| Smiles: | Cc1ccc(cc1)NC(c1nnc(SCC(NCc2cccc(c2)[Br])=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3307 |
| logD: | 4.3307 |
| logSw: | -4.2951 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 70.395 |
| InChI Key: | FCMCIVSELRGNMD-UHFFFAOYSA-N |