N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | Y205-0016 |
| Compound Name: | N-{1-[(3,4-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 418.28 |
| Molecular Formula: | C20 H17 Cl2 N3 O3 |
| Smiles: | Cc1c(c(C)n(Cc2ccc(c(c2)[Cl])[Cl])n1)NC(c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7501 |
| logD: | 3.7498 |
| logSw: | -4.2267 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.331 |
| InChI Key: | SRWSLCDIWNOLEF-UHFFFAOYSA-N |