N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide
Chemical Structure Depiction of
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide
N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide
Compound characteristics
| Compound ID: | V013-4619 |
| Compound Name: | N-{2-[5-(2H-1,3-benzodioxol-5-yl)-3-(4-methoxyphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-3,3-dimethyl-N-[2-(morpholin-4-yl)ethyl]butanamide |
| Molecular Weight: | 564.68 |
| Molecular Formula: | C31 H40 N4 O6 |
| Salt: | not_available |
| Smiles: | CC(C)(C)CC(N(CCN1CCOCC1)CC(N1C(CC(c2ccc(cc2)OC)=N1)c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.2856 |
| logD: | 4.2593 |
| logSw: | -4.3468 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.071 |
| InChI Key: | BADHVRLGVGDLFQ-SANMLTNESA-N |