N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-2-methylpropanamide
Chemical Structure Depiction of
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-2-methylpropanamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-2-methylpropanamide
Compound characteristics
| Compound ID: | V006-3382 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-2-methylpropanamide |
| Molecular Weight: | 479.58 |
| Molecular Formula: | C27 H33 N3 O5 |
| Smiles: | CC(C)C(N(CCOC)CC(N1C(CC(c2ccc(C)c(C)c2)=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7105 |
| logD: | 4.7105 |
| logSw: | -4.4897 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 68.778 |
| InChI Key: | CTUCTTWIVCVMGJ-QHCPKHFHSA-N |