N-{2-[5-(furan-2-yl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-(propan-2-yl)urea
Chemical Structure Depiction of
N-{2-[5-(furan-2-yl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-(propan-2-yl)urea
N-{2-[5-(furan-2-yl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-(propan-2-yl)urea
Compound characteristics
| Compound ID: | V005-4616 |
| Compound Name: | N-{2-[5-(furan-2-yl)-3-(4-nitrophenyl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)-N'-(propan-2-yl)urea |
| Molecular Weight: | 457.49 |
| Molecular Formula: | C22 H27 N5 O6 |
| Smiles: | CC(C)NC(N(CCOC)CC(N1C(CC(c2ccc(cc2)[N+]([O-])=O)=N1)c1ccco1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8748 |
| logD: | 2.8748 |
| logSw: | -3.3268 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 102.739 |
| InChI Key: | OHYFSAPDAZZPSQ-LJQANCHMSA-N |