N-(2-ethoxyphenyl)-2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2-ethoxyphenyl)-2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
N-(2-ethoxyphenyl)-2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | F884-0087 |
| Compound Name: | N-(2-ethoxyphenyl)-2-{[(9-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]sulfanyl}acetamide |
| Molecular Weight: | 383.47 |
| Molecular Formula: | C20 H21 N3 O3 S |
| Smiles: | CCOc1ccccc1NC(CSCC1=CC(N2C=CC=C(C)C2=N1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7972 |
| logD: | 2.7971 |
| logSw: | -3.2339 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.636 |
| InChI Key: | YLLLPVSHSXDTPJ-UHFFFAOYSA-N |