N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide
Chemical Structure Depiction of
N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide
N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide
Compound characteristics
Compound ID: | V006-5252 |
Compound Name: | N-{2-[5-(4-chlorophenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-3,3-dimethylbutanamide |
Molecular Weight: | 473.01 |
Molecular Formula: | C25 H33 Cl N4 O3 |
Smiles: | CC(C)(C)CC(N(CCOC)CC(N1C(CC(c2cccn2C)=N1)c1ccc(cc1)[Cl])=O)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 5.023 |
logD: | 5.023 |
logSw: | -5.289 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 53.552 |
InChI Key: | AGNXYGFPLYIMAO-QFIPXVFZSA-N |