1-(3-methylphenyl)-3-(4-methylphenyl)-4-{4-[(4-methylphenyl)carbamamido]phenyl}-1H-pyrazol-5-yl acetate
Chemical Structure Depiction of
1-(3-methylphenyl)-3-(4-methylphenyl)-4-{4-[(4-methylphenyl)carbamamido]phenyl}-1H-pyrazol-5-yl acetate
1-(3-methylphenyl)-3-(4-methylphenyl)-4-{4-[(4-methylphenyl)carbamamido]phenyl}-1H-pyrazol-5-yl acetate
Compound characteristics
| Compound ID: | V017-2671 |
| Compound Name: | 1-(3-methylphenyl)-3-(4-methylphenyl)-4-{4-[(4-methylphenyl)carbamamido]phenyl}-1H-pyrazol-5-yl acetate |
| Molecular Weight: | 530.63 |
| Molecular Formula: | C33 H30 N4 O3 |
| Smiles: | CC(=O)Oc1c(c2ccc(cc2)NC(Nc2ccc(C)cc2)=O)c(c2ccc(C)cc2)nn1c1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 8.0815 |
| logD: | 8.0815 |
| logSw: | -5.6813 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 66.877 |
| InChI Key: | KPBPKRZPAMWKNC-UHFFFAOYSA-N |