3-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-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-[(propan-2-yl)oxy]propyl}-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
3-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | E213-0450 |
| Compound Name: | 3-methyl-4-oxo-N-{3-[(propan-2-yl)oxy]propyl}-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 377.5 |
| Molecular Formula: | C19 H27 N3 O3 S |
| Smiles: | CC(C)OCCCNC(c1c(C)c2C(N3CCCCCC3=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1289 |
| logD: | 2.1289 |
| logSw: | -2.4547 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.349 |
| InChI Key: | NXTPGDPNFYRIPH-UHFFFAOYSA-N |