N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-4-methoxy-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-4-methoxy-N-(2-methoxyethyl)benzamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-4-methoxy-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V030-5503 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-4-methoxy-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 518.57 |
| Molecular Formula: | C28 H30 N4 O6 |
| Smiles: | Cn1cccc1C1CC(c2ccc3c(c2)OCO3)N(C(CN(CCOC)C(c2ccc(cc2)OC)=O)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8079 |
| logD: | 3.8079 |
| logSw: | -4.0234 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.467 |
| InChI Key: | ZBSLAWZLBFFUEW-DEOSSOPVSA-N |