N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Chemical Structure Depiction of
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide
Compound characteristics
| Compound ID: | C226-3417 |
| Compound Name: | N-{1-[(2,6-dichlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl}-4,5,6,7-tetrahydro-1,2-benzoxazole-3-carboxamide |
| Molecular Weight: | 419.31 |
| Molecular Formula: | C20 H20 Cl2 N4 O2 |
| Smiles: | Cc1c(c(C)n(Cc2c(cccc2[Cl])[Cl])n1)NC(c1c2CCCCc2on1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5547 |
| logD: | 3.5539 |
| logSw: | -3.7924 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.616 |
| InChI Key: | IHLDZISZBUQSSI-UHFFFAOYSA-N |