ethyl 4-[({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)(propan-2-yl)amino]-4-oxobutanoate
Chemical Structure Depiction of
ethyl 4-[({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)(propan-2-yl)amino]-4-oxobutanoate
ethyl 4-[({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)(propan-2-yl)amino]-4-oxobutanoate
Compound characteristics
| Compound ID: | V014-0620 |
| Compound Name: | ethyl 4-[({1-(3-fluorophenyl)-3-methyl-5-[4-(propan-2-yl)piperazin-1-yl]-1H-pyrazol-4-yl}methyl)(propan-2-yl)amino]-4-oxobutanoate |
| Molecular Weight: | 501.64 |
| Molecular Formula: | C27 H40 F N5 O3 |
| Salt: | not_available |
| Smiles: | CCOC(CCC(N(Cc1c(C)nn(c2cccc(c2)F)c1N1CCN(CC1)C(C)C)C(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1071 |
| logD: | 1.6781 |
| logSw: | -4.1909 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 56.636 |
| InChI Key: | XEWHTSFOHYNAGR-UHFFFAOYSA-N |