2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0095 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-propyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 343.49 |
| Molecular Formula: | C19 H25 N3 O S |
| Smiles: | CCCN1CCC2=C(C1)C(NC(=N2)SCc1cc(C)ccc1C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6533 |
| logD: | 3.2518 |
| logSw: | -3.6214 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.196 |
| InChI Key: | QXNQKQXHEIGJOT-UHFFFAOYSA-N |