1,3-bis(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
1,3-bis(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
1,3-bis(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V021-9727 |
| Compound Name: | 1,3-bis(3-methylphenyl)-4-[4-(2-phenylacetamido)phenyl]-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 515.61 |
| Molecular Formula: | C33 H29 N3 O3 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(Cc2ccccc2)=O)c(c2cccc(C)c2)nn1c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 6.9307 |
| logD: | 6.9306 |
| logSw: | -5.7752 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.452 |
| InChI Key: | NCQBIAPUOFEMSY-UHFFFAOYSA-N |