4-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
Chemical Structure Depiction of
4-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
4-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide
Compound characteristics
| Compound ID: | Y500-7801 |
| Compound Name: | 4-{[(2,3-dihydro-1H-inden-5-yl)oxy]methyl}-N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)benzamide |
| Molecular Weight: | 453.54 |
| Molecular Formula: | C28 H27 N3 O3 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)NC(c1ccc(COc2ccc3CCCc3c2)cc1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8739 |
| logD: | 3.1614 |
| logSw: | -4.0493 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.225 |
| InChI Key: | HQIWDKYIRACGKI-UHFFFAOYSA-N |