ethyl (5-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
Chemical Structure Depiction of
ethyl (5-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
ethyl (5-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate
Compound characteristics
| Compound ID: | 8014-1948 |
| Compound Name: | ethyl (5-{2-[(1-phenyl-1H-tetrazol-5-yl)sulfanyl]butanamido}-1,3,4-thiadiazol-2-yl)acetate |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C17 H19 N7 O3 S2 |
| Smiles: | CCC(C(Nc1nnc(CC(=O)OCC)s1)=O)Sc1nnnn1c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0387 |
| logD: | 3.0014 |
| logSw: | -3.3221 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 107.451 |
| InChI Key: | BFTMBRHGLCVUBW-LBPRGKRZSA-N |