methyl 5-(propan-2-yl)-2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-(propan-2-yl)-2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazole-4-carboxylate
methyl 5-(propan-2-yl)-2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-3789 |
| Compound Name: | methyl 5-(propan-2-yl)-2-{4-[2-(propan-2-yl)-2H-tetrazol-5-yl]benzamido}-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 414.48 |
| Molecular Formula: | C19 H22 N6 O3 S |
| Smiles: | CC(C)c1c(C(=O)OC)nc(NC(c2ccc(cc2)c2nnn(C(C)C)n2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 3.8196 |
| logD: | 3.2191 |
| logSw: | -4.1092 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 93.556 |
| InChI Key: | MRKYMFXTOLKSKT-UHFFFAOYSA-N |