N'-tert-butyl-N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
N'-tert-butyl-N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
Compound characteristics
| Compound ID: | V012-3924 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(4-chlorophenyl)-3-(3,4-dimethylphenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea |
| Molecular Weight: | 554.13 |
| Molecular Formula: | C30 H40 Cl N5 O3 |
| Salt: | not_available |
| Smiles: | Cc1ccc(cc1C)C1CC(c2ccc(cc2)[Cl])N(C(CN(CCN2CCOCC2)C(NC(C)(C)C)=O)=O)N=1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.379 |
| logD: | 4.6283 |
| logSw: | -6.1833 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.906 |
| InChI Key: | PXZIPRZBAITINM-MHZLTWQESA-N |