2-(3-bromophenyl)-4-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
2-(3-bromophenyl)-4-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
2-(3-bromophenyl)-4-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 2000-0156 |
| Compound Name: | 2-(3-bromophenyl)-4-({3-methoxy-4-[(propan-2-yl)oxy]phenyl}methylidene)-5-methyl-2,4-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 429.31 |
| Molecular Formula: | C21 H21 Br N2 O3 |
| Smiles: | CC(C)Oc1ccc(\C=C2/C(C)=NN(C2=O)c2cccc(c2)[Br])cc1OC |
| Stereo: | ACHIRAL |
| logP: | 4.7014 |
| logD: | 4.7014 |
| logSw: | -4.6169 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.106 |
| InChI Key: | OQLKUKFOILDKOQ-UHFFFAOYSA-N |