2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(3-methoxypropyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(3-methoxypropyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(3-methoxypropyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | L872-0117 |
| Compound Name: | 2-{[(2,5-dimethylphenyl)methyl]sulfanyl}-6-(3-methoxypropyl)-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 373.52 |
| Molecular Formula: | C20 H27 N3 O2 S |
| Smiles: | Cc1ccc(C)c(CSC2NC(C3CN(CCCOC)CCC=3N=2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.1012 |
| logD: | 2.6998 |
| logSw: | -3.1702 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.538 |
| InChI Key: | ALCJFCROMGURLV-UHFFFAOYSA-N |