methyl 4-[4-({4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Chemical Structure Depiction of
methyl 4-[4-({4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
methyl 4-[4-({4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate
Compound characteristics
| Compound ID: | 3977-1384 |
| Compound Name: | methyl 4-[4-({4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl}methylidene)-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl]benzoate |
| Molecular Weight: | 490.94 |
| Molecular Formula: | C27 H23 Cl N2 O5 |
| Smiles: | CC1/C(=C/c2ccc(c(c2)OC)OCc2ccc(cc2)[Cl])C(N(c2ccc(cc2)C(=O)OC)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4123 |
| logD: | 5.4123 |
| logSw: | -6.1877 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 61.705 |
| InChI Key: | INWLADADDRUBTH-UHFFFAOYSA-N |