3-methyl-N-[3-(3-methylpiperidin-1-yl)propyl]-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-[3-(3-methylpiperidin-1-yl)propyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
3-methyl-N-[3-(3-methylpiperidin-1-yl)propyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0562 |
| Compound Name: | 3-methyl-N-[3-(3-methylpiperidin-1-yl)propyl]-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 416.58 |
| Molecular Formula: | C22 H32 N4 O2 S |
| Smiles: | CC1CCCN(CCCNC(c2c(C)c3C(N4CCCCCC4=Nc3s2)=O)=O)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5522 |
| logD: | -0.0194 |
| logSw: | -2.6052 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 54.793 |
| InChI Key: | QZZCFAOGXKISFY-HNNXBMFYSA-N |