2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-N-(4-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Chemical Structure Depiction of
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-N-(4-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-N-(4-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
Compound characteristics
| Compound ID: | D314-0509 |
| Compound Name: | 2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]-3,5-dimethyl-1H-pyrazol-1-yl}-N-(4-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide |
| Molecular Weight: | 490.58 |
| Molecular Formula: | C26 H26 N4 O4 S |
| Smiles: | CCOc1ccc(cc1)NC(c1c(C)nc(n2c(C)c(Cc3ccc4c(c3)OCO4)c(C)n2)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2587 |
| logD: | 5.2582 |
| logSw: | -5.103 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.112 |
| InChI Key: | JBNHWHDSCUJZCP-UHFFFAOYSA-N |