4-{[(6-bromo-2-hydroxynaphthalen-1-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Chemical Structure Depiction of
4-{[(6-bromo-2-hydroxynaphthalen-1-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
4-{[(6-bromo-2-hydroxynaphthalen-1-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one
Compound characteristics
| Compound ID: | 1685-0093 |
| Compound Name: | 4-{[(6-bromo-2-hydroxynaphthalen-1-yl)methylidene]amino}-1,5-dimethyl-2-phenyl-1,2-dihydro-3H-pyrazol-3-one |
| Molecular Weight: | 436.31 |
| Molecular Formula: | C22 H18 Br N3 O2 |
| Smiles: | CC1=C(C(N(c2ccccc2)N1C)=O)/N=C\c1c(ccc2cc(ccc12)[Br])O |
| Stereo: | ACHIRAL |
| logP: | 4.2166 |
| logD: | 4.2143 |
| logSw: | -4.346 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.024 |
| InChI Key: | LCINCOZXSVEFDR-UHFFFAOYSA-N |