propan-2-yl 3-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
Chemical Structure Depiction of
propan-2-yl 3-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
propan-2-yl 3-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate
Compound characteristics
| Compound ID: | 8011-8586 |
| Compound Name: | propan-2-yl 3-{2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]acetamido}benzoate |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C14 H16 N4 O3 S2 |
| Smiles: | CC(C)OC(c1cccc(c1)NC(CSc1nnc(N)s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4717 |
| logD: | 2.4717 |
| logSw: | -2.9374 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.212 |
| InChI Key: | KAVLQPKLORUJNG-UHFFFAOYSA-N |