3-{[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl](propan-2-yl)amino}-2-hydroxypropyl butanoate
Chemical Structure Depiction of
3-{[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl](propan-2-yl)amino}-2-hydroxypropyl butanoate
3-{[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl](propan-2-yl)amino}-2-hydroxypropyl butanoate
Compound characteristics
| Compound ID: | V004-3928 |
| Compound Name: | 3-{[(3-ethyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl](propan-2-yl)amino}-2-hydroxypropyl butanoate |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C28 H37 N3 O4 |
| Salt: | not_available |
| Smiles: | CCCC(=O)OCC(CN(Cc1c(CC)nn(c2ccccc2)c1Oc1ccccc1)C(C)C)O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5596 |
| logD: | 2.892 |
| logSw: | -5.3703 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.382 |
| InChI Key: | COKFWXLODKKFKB-QHCPKHFHSA-N |