4-({3-bromo-5-methoxy-4-[(pyridin-2-yl)methoxy]phenyl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-({3-bromo-5-methoxy-4-[(pyridin-2-yl)methoxy]phenyl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
4-({3-bromo-5-methoxy-4-[(pyridin-2-yl)methoxy]phenyl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 5425-0445 |
| Compound Name: | 4-({3-bromo-5-methoxy-4-[(pyridin-2-yl)methoxy]phenyl}methylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 478.34 |
| Molecular Formula: | C24 H20 Br N3 O3 |
| Smiles: | CC1/C(=C\c2cc(c(c(c2)[Br])OCc2ccccn2)OC)C(N(c2ccccc2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3438 |
| logD: | 4.3438 |
| logSw: | -4.4353 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 50.161 |
| InChI Key: | ZSMIBZYJQZMCQB-UHFFFAOYSA-N |