3-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
3-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0560 |
| Compound Name: | 3-methyl-N-[2-(2-methylpiperidin-1-yl)ethyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 402.56 |
| Molecular Formula: | C21 H30 N4 O2 S |
| Smiles: | CC1CCCCN1CCNC(c1c(C)c2C(N3CCCCCC3=Nc2s1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1996 |
| logD: | 0.6669 |
| logSw: | -2.4695 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.31 |
| InChI Key: | JBCAQHSIIBFDCD-AWEZNQCLSA-N |