N-(2-ethylphenyl)-N,3-dimethyl-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-(2-ethylphenyl)-N,3-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
N-(2-ethylphenyl)-N,3-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0416 |
| Compound Name: | N-(2-ethylphenyl)-N,3-dimethyl-4-oxo-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 395.52 |
| Molecular Formula: | C22 H25 N3 O2 S |
| Smiles: | CCc1ccccc1N(C)C(c1c(C)c2C(N3CCCCCC3=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8856 |
| logD: | 3.8856 |
| logSw: | -4.0253 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 41.69 |
| InChI Key: | PFOIICAKINQQIF-UHFFFAOYSA-N |