3-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-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-(3,4,5-trimethoxyphenyl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
3-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0338 |
| Compound Name: | 3-methyl-4-oxo-N-(3,4,5-trimethoxyphenyl)-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | Cc1c2C(N3CCCCCC3=Nc2sc1C(Nc1cc(c(c(c1)OC)OC)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.546 |
| logD: | 2.4063 |
| logSw: | -2.9206 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.691 |
| InChI Key: | QGQDKJMFWMVPLS-UHFFFAOYSA-N |