2-(azepane-1-carbonyl)-9-methyl-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-9-methyl-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
2-(azepane-1-carbonyl)-9-methyl-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one
Compound characteristics
| Compound ID: | C243-0268 |
| Compound Name: | 2-(azepane-1-carbonyl)-9-methyl-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-4-one |
| Molecular Weight: | 341.43 |
| Molecular Formula: | C18 H19 N3 O2 S |
| Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(N3CCCCCC3)=O)s1)C2=O |
| Stereo: | ACHIRAL |
| logP: | 3.1041 |
| logD: | 3.1041 |
| logSw: | -3.1552 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.387 |
| InChI Key: | FAPVZSRGFZLAQP-UHFFFAOYSA-N |