2-{3-[(2,5-dimethylphenyl)methyl]-1,3-diazinane-1-carbonyl}-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-{3-[(2,5-dimethylphenyl)methyl]-1,3-diazinane-1-carbonyl}-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
2-{3-[(2,5-dimethylphenyl)methyl]-1,3-diazinane-1-carbonyl}-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | E213-0879 |
| Compound Name: | 2-{3-[(2,5-dimethylphenyl)methyl]-1,3-diazinane-1-carbonyl}-3-methyl-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 450.6 |
| Molecular Formula: | C25 H30 N4 O2 S |
| Smiles: | Cc1ccc(C)c(CN2CCCN(C2)C(c2c(C)c3C(N4CCCCC4=Nc3s2)=O)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.1023 |
| logD: | 4.0093 |
| logSw: | -4.1707 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.22 |
| InChI Key: | SCNQWWNAIUAWPA-UHFFFAOYSA-N |