N-{5-[(3-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-(morpholine-4-sulfonyl)benzamide
Chemical Structure Depiction of
N-{5-[(3-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-(morpholine-4-sulfonyl)benzamide
N-{5-[(3-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-(morpholine-4-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 8006-8474 |
| Compound Name: | N-{5-[(3-methylphenyl)methyl]-1,3,4-thiadiazol-2-yl}-3-(morpholine-4-sulfonyl)benzamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C21 H22 N4 O4 S2 |
| Smiles: | Cc1cccc(Cc2nnc(NC(c3cccc(c3)S(N3CCOCC3)(=O)=O)=O)s2)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.6172 |
| logD: | 2.8653 |
| logSw: | -3.7391 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.718 |
| InChI Key: | VFZYLPBIMGEGFQ-UHFFFAOYSA-N |