N-(4-methylphenyl)-5-{[(4-propylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-5-{[(4-propylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(4-methylphenyl)-5-{[(4-propylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0079 |
| Compound Name: | N-(4-methylphenyl)-5-{[(4-propylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 430.55 |
| Molecular Formula: | C20 H22 N4 O3 S2 |
| Smiles: | CCCc1ccc(cc1)S(NCc1nnc(C(Nc2ccc(C)cc2)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5315 |
| logD: | 4.3957 |
| logSw: | -4.1733 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.087 |
| InChI Key: | QTOJNFREGQWIRJ-UHFFFAOYSA-N |