N-[(2-chlorophenyl)methyl]-4-[3-(2,3-dihydro-1,4-benzodioxin-5-yl)-1H-pyrazol-5-yl]benzamide
Chemical Structure Depiction of
N-[(2-chlorophenyl)methyl]-4-[3-(2,3-dihydro-1,4-benzodioxin-5-yl)-1H-pyrazol-5-yl]benzamide
N-[(2-chlorophenyl)methyl]-4-[3-(2,3-dihydro-1,4-benzodioxin-5-yl)-1H-pyrazol-5-yl]benzamide
Compound characteristics
| Compound ID: | V001-4556 |
| Compound Name: | N-[(2-chlorophenyl)methyl]-4-[3-(2,3-dihydro-1,4-benzodioxin-5-yl)-1H-pyrazol-5-yl]benzamide |
| Molecular Weight: | 445.9 |
| Molecular Formula: | C25 H20 Cl N3 O3 |
| Salt: | not_available |
| Smiles: | C(c1ccccc1[Cl])NC(c1ccc(cc1)c1cc(c2cccc3c2OCCO3)n[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9607 |
| logD: | 4.9607 |
| logSw: | -5.0422 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.377 |
| InChI Key: | BFTCHTQTQCUKQG-UHFFFAOYSA-N |