propan-2-yl 4-(3-methyl-4-{[4-(morpholin-4-yl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoate
Chemical Structure Depiction of
propan-2-yl 4-(3-methyl-4-{[4-(morpholin-4-yl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoate
propan-2-yl 4-(3-methyl-4-{[4-(morpholin-4-yl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoate
Compound characteristics
| Compound ID: | 3871-0324 |
| Compound Name: | propan-2-yl 4-(3-methyl-4-{[4-(morpholin-4-yl)phenyl]methylidene}-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzoate |
| Molecular Weight: | 433.51 |
| Molecular Formula: | C25 H27 N3 O4 |
| Smiles: | CC(C)OC(c1ccc(cc1)N1C(C(=C/c2ccc(cc2)N2CCOCC2)\C(C)=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0019 |
| logD: | 4.0019 |
| logSw: | -4.1346 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.381 |
| InChI Key: | XWTPDMCOFIDURW-UHFFFAOYSA-N |