N-(3-chlorophenyl)-5-{[(4-propanamidobenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-5-{[(4-propanamidobenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
N-(3-chlorophenyl)-5-{[(4-propanamidobenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0208 |
| Compound Name: | N-(3-chlorophenyl)-5-{[(4-propanamidobenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 479.96 |
| Molecular Formula: | C19 H18 Cl N5 O4 S2 |
| Smiles: | CCC(Nc1ccc(cc1)S(NCc1nnc(C(Nc2cccc(c2)[Cl])=O)s1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1654 |
| logD: | 2.9772 |
| logSw: | -3.6222 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 112.237 |
| InChI Key: | PZSQNULVXLQLDB-UHFFFAOYSA-N |