3-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Chemical Structure Depiction of
3-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
3-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0486 |
| Compound Name: | 3-methyl-4-oxo-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C23 H25 N3 O2 S |
| Smiles: | Cc1c2C(N3CCCCCC3=Nc2sc1C(NC1CCCc2ccccc12)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.9821 |
| logD: | 3.9794 |
| logSw: | -4.1662 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.879 |
| InChI Key: | QTOSRZOWLOWRFU-KRWDZBQOSA-N |