2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Chemical Structure Depiction of
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one
Compound characteristics
| Compound ID: | 5585-0304 |
| Compound Name: | 2-{[(3,4-dichlorophenyl)methyl]sulfanyl}-3-(2-methylphenyl)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4(3H)-one |
| Molecular Weight: | 482.43 |
| Molecular Formula: | C25 H21 Cl2 N3 O S |
| Smiles: | Cc1ccccc1N1C(=Nc2c(cc3CCCCc3n2)C1=O)SCc1ccc(c(c1)[Cl])[Cl] |
| Stereo: | ACHIRAL |
| logP: | 7.0998 |
| logD: | 7.0563 |
| logSw: | -6.2923 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 35.472 |
| InChI Key: | UWGYGLHNUZSHET-UHFFFAOYSA-N |