ethyl 6-amino-5-cyano-2-methyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-4H-pyran-3-carboxylate
Chemical Structure Depiction of
ethyl 6-amino-5-cyano-2-methyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-4H-pyran-3-carboxylate
ethyl 6-amino-5-cyano-2-methyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-4H-pyran-3-carboxylate
Compound characteristics
| Compound ID: | 8016-8945 |
| Compound Name: | ethyl 6-amino-5-cyano-2-methyl-4-(4-{[(1-methyl-1H-tetrazol-5-yl)sulfanyl]methyl}thiophen-2-yl)-4H-pyran-3-carboxylate |
| Molecular Weight: | 418.49 |
| Molecular Formula: | C17 H18 N6 O3 S2 |
| Smiles: | CCOC(C1C(C(C#N)=C(N)OC=1C)c1cc(CSc2nnnn2C)cs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6313 |
| logD: | 1.6313 |
| logSw: | -2.0643 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 108.536 |
| InChI Key: | PHDZBLLRNJGMOW-AWEZNQCLSA-N |