N-{1-[6-ethyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]-4-methylpentyl}-N'-[(4-methylphenyl)methyl]urea
Chemical Structure Depiction of
N-{1-[6-ethyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]-4-methylpentyl}-N'-[(4-methylphenyl)methyl]urea
N-{1-[6-ethyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]-4-methylpentyl}-N'-[(4-methylphenyl)methyl]urea
Compound characteristics
| Compound ID: | E635-0431 |
| Compound Name: | N-{1-[6-ethyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]-4-methylpentyl}-N'-[(4-methylphenyl)methyl]urea |
| Molecular Weight: | 478.7 |
| Molecular Formula: | C28 H38 N4 O S |
| Smiles: | CCN1CCc2c(C(CCC(C)C)NC(NCc3ccc(C)cc3)=O)c(n3cccc3)sc2C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9035 |
| logD: | 3.1903 |
| logSw: | -5.3125 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.262 |
| InChI Key: | DHKOSQDIEVGQFP-DEOSSOPVSA-N |