N-benzyl-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-benzyl-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea
N-benzyl-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: | E635-0057 |
| Compound Name: | N-benzyl-N'-{[6-methyl-2-(1H-pyrrol-1-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-3-yl]methyl}urea |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C21 H24 N4 O S |
| Smiles: | CN1CCc2c(CNC(NCc3ccccc3)=O)c(n3cccc3)sc2C1 |
| Stereo: | ACHIRAL |
| logP: | 3.0349 |
| logD: | 1.2711 |
| logSw: | -3.3976 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 43.571 |
| InChI Key: | KKXWEGKFHUDDDV-UHFFFAOYSA-N |