N-(4-ethoxyphenyl)-N-ethyl-3-methyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-N-ethyl-3-methyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
N-(4-ethoxyphenyl)-N-ethyl-3-methyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0433 |
| Compound Name: | N-(4-ethoxyphenyl)-N-ethyl-3-methyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 425.55 |
| Molecular Formula: | C23 H27 N3 O3 S |
| Smiles: | CCN(C(c1c(C)c2C(N3CCCCCC3=Nc2s1)=O)=O)c1ccc(cc1)OCC |
| Stereo: | ACHIRAL |
| logP: | 4.0803 |
| logD: | 4.0803 |
| logSw: | -4.1293 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 49.093 |
| InChI Key: | KHXHWCGZJXZNJO-UHFFFAOYSA-N |