N-phenyl-5-{[(2,4,5-trimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Chemical Structure Depiction of
N-phenyl-5-{[(2,4,5-trimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
N-phenyl-5-{[(2,4,5-trimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide
Compound characteristics
| Compound ID: | L063-0453 |
| Compound Name: | N-phenyl-5-{[(2,4,5-trimethylbenzene-1-sulfonyl)amino]methyl}-1,3,4-thiadiazole-2-carboxamide |
| Molecular Weight: | 416.52 |
| Molecular Formula: | C19 H20 N4 O3 S2 |
| Smiles: | Cc1cc(C)c(cc1C)S(NCc1nnc(C(Nc2ccccc2)=O)s1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8149 |
| logD: | 3.569 |
| logSw: | -3.9046 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.087 |
| InChI Key: | VBZRJMLPOQOXEG-UHFFFAOYSA-N |