N-(3-chloro-4-fluorophenyl)-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-(3-chloro-4-fluorophenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea
N-(3-chloro-4-fluorophenyl)-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: | E635-0023 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea |
| Molecular Weight: | 418.92 |
| Molecular Formula: | C20 H20 Cl F N4 O S |
| Smiles: | CN1CCc2c(CNC(Nc3ccc(c(c3)[Cl])F)=O)c(n3cccc3)sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 4.5164 |
| logD: | 2.7526 |
| logSw: | -4.6256 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 42.249 |
| InChI Key: | FATGKKPBALOUQR-UHFFFAOYSA-N |