2-(azepane-1-carbonyl)-3-methyl-7,8-dihydropyrrolo[1,2-a]thieno[2,3-d]pyrimidin-4(6H)-one
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-3-methyl-7,8-dihydropyrrolo[1,2-a]thieno[2,3-d]pyrimidin-4(6H)-one
2-(azepane-1-carbonyl)-3-methyl-7,8-dihydropyrrolo[1,2-a]thieno[2,3-d]pyrimidin-4(6H)-one
Compound characteristics
| Compound ID: | E213-0939 |
| Compound Name: | 2-(azepane-1-carbonyl)-3-methyl-7,8-dihydropyrrolo[1,2-a]thieno[2,3-d]pyrimidin-4(6H)-one |
| Molecular Weight: | 331.43 |
| Molecular Formula: | C17 H21 N3 O2 S |
| Smiles: | Cc1c2C(N3CCCC3=Nc2sc1C(N1CCCCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3122 |
| logD: | 2.3122 |
| logSw: | -2.1663 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.636 |
| InChI Key: | MZXJYGJBFUZGHO-UHFFFAOYSA-N |