1-[{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-[{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
1-[{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V031-0394 |
| Compound Name: | 1-[{[5-(2-chlorophenoxy)-1-methyl-3-phenyl-1H-pyrazol-4-yl]methyl}(2-methoxyethyl)amino]-3-[(prop-2-en-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 486.01 |
| Molecular Formula: | C26 H32 Cl N3 O4 |
| Salt: | not_available |
| Smiles: | Cn1c(c(CN(CCOC)CC(COCC=C)O)c(c2ccccc2)n1)Oc1ccccc1[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.597 |
| logD: | 2.3309 |
| logSw: | -3.8797 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.627 |
| InChI Key: | KBUMYTIKEAMMFK-NRFANRHFSA-N |