N'-tert-butyl-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-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-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
N'-tert-butyl-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea
Compound characteristics
| Compound ID: | V006-9753 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(4-methoxyphenyl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-[2-(morpholin-4-yl)ethyl]urea |
| Molecular Weight: | 566.66 |
| Molecular Formula: | C29 H38 N6 O6 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CCN1CCOCC1)CC(N1C(CC(c2ccc(cc2)[N+]([O-])=O)=N1)c1ccc(cc1)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7322 |
| logD: | 2.9815 |
| logSw: | -3.9663 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.831 |
| InChI Key: | OKGWSMJJXZSABZ-AREMUKBSSA-N |