1-[3-(3,4-dimethylphenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one
Chemical Structure Depiction of
1-[3-(3,4-dimethylphenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one
1-[3-(3,4-dimethylphenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V018-9430 |
| Compound Name: | 1-[3-(3,4-dimethylphenyl)-5-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-(4-ethylpiperazin-1-yl)ethan-1-one |
| Molecular Weight: | 407.56 |
| Molecular Formula: | C24 H33 N5 O |
| Smiles: | CCN1CCN(CC1)CC(N1C(CC(c2ccc(C)c(C)c2)=N1)c1cccn1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7015 |
| logD: | 2.9076 |
| logSw: | -3.7696 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.545 |
| InChI Key: | QCIKCKPQCXPETP-QHCPKHFHSA-N |