methyl 5-benzyl-2-[3-(1H-tetrazol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Chemical Structure Depiction of
methyl 5-benzyl-2-[3-(1H-tetrazol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
methyl 5-benzyl-2-[3-(1H-tetrazol-1-yl)propanamido]-1,3-thiazole-4-carboxylate
Compound characteristics
| Compound ID: | Y043-6046 |
| Compound Name: | methyl 5-benzyl-2-[3-(1H-tetrazol-1-yl)propanamido]-1,3-thiazole-4-carboxylate |
| Molecular Weight: | 372.4 |
| Molecular Formula: | C16 H16 N6 O3 S |
| Smiles: | COC(c1c(Cc2ccccc2)sc(NC(CCn2cnnn2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.218 |
| logD: | 2.2026 |
| logSw: | -2.7213 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 94.999 |
| InChI Key: | XRJQFJLIAKIWKP-UHFFFAOYSA-N |