N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}propanamide
Chemical Structure Depiction of
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}propanamide
N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}propanamide
Compound characteristics
| Compound ID: | V002-9556 |
| Compound Name: | N-benzyl-N-{[1-(3-chlorophenyl)-3-methyl-5-phenoxy-1H-pyrazol-4-yl]methyl}propanamide |
| Molecular Weight: | 459.98 |
| Molecular Formula: | C27 H26 Cl N3 O2 |
| Smiles: | CCC(N(Cc1ccccc1)Cc1c(C)nn(c2cccc(c2)[Cl])c1Oc1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0198 |
| logD: | 6.0198 |
| logSw: | -5.9525 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 36.604 |
| InChI Key: | BCKBHVLVKAYEBN-UHFFFAOYSA-N |