methyl 4-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
methyl 4-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
methyl 4-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8008-4832 |
| Compound Name: | methyl 4-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 324.38 |
| Molecular Formula: | C12 H12 N4 O3 S2 |
| Smiles: | COC(c1ccc(cc1)NC(CSc1nnc(N)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6862 |
| logD: | 1.6861 |
| logSw: | -2.3444 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.953 |
| InChI Key: | QYPJEWFRLGRDSD-UHFFFAOYSA-N |