N-(5-chloro-2-methoxyphenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea
Chemical Structure Depiction of
N-(5-chloro-2-methoxyphenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea
N-(5-chloro-2-methoxyphenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea
Compound characteristics
| Compound ID: | E635-0017 |
| Compound Name: | N-(5-chloro-2-methoxyphenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea |
| Molecular Weight: | 430.96 |
| Molecular Formula: | C21 H23 Cl N4 O2 S |
| Smiles: | CN1CCc2c(CNC(Nc3cc(ccc3OC)[Cl])=O)c(n3cccc3)sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.0401 |
| logD: | 2.2762 |
| logSw: | -4.5504 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.181 |
| InChI Key: | NMQHKPFXAWJEOW-UHFFFAOYSA-N |