N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Chemical Structure Depiction of
N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea
Compound characteristics
| Compound ID: | V026-0811 |
| Compound Name: | N'-tert-butyl-N-{2-[5-(2,5-dimethoxyphenyl)-3-(1-methyl-1H-pyrrol-2-yl)-4,5-dihydro-1H-pyrazol-1-yl]-2-oxoethyl}-N-(2-methoxyethyl)urea |
| Molecular Weight: | 499.61 |
| Molecular Formula: | C26 H37 N5 O5 |
| Salt: | not_available |
| Smiles: | CC(C)(C)NC(N(CCOC)CC(N1C(CC(c2cccn2C)=N1)c1cc(ccc1OC)OC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1023 |
| logD: | 4.102 |
| logSw: | -4.2143 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.22 |
| InChI Key: | DOWDKLHLCIBGOY-QFIPXVFZSA-N |