1-{(cyclopropylmethyl)[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Chemical Structure Depiction of
1-{(cyclopropylmethyl)[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
1-{(cyclopropylmethyl)[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol
Compound characteristics
| Compound ID: | V004-4226 |
| Compound Name: | 1-{(cyclopropylmethyl)[(3-methyl-5-phenoxy-1-phenyl-1H-pyrazol-4-yl)methyl]amino}-3-[(prop-2-yn-1-yl)oxy]propan-2-ol |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C27 H31 N3 O3 |
| Salt: | not_available |
| Smiles: | Cc1c(CN(CC2CC2)CC(COCC#C)O)c(n(c2ccccc2)n1)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.3229 |
| logD: | 1.6825 |
| logSw: | -4.3209 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.127 |
| InChI Key: | AEJQSBSUTVAOMQ-DEOSSOPVSA-N |