N-cyclopentyl-3-methyl-4-oxo-N-[(thiophen-2-yl)methyl]-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Chemical Structure Depiction of
N-cyclopentyl-3-methyl-4-oxo-N-[(thiophen-2-yl)methyl]-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
N-cyclopentyl-3-methyl-4-oxo-N-[(thiophen-2-yl)methyl]-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide
Compound characteristics
| Compound ID: | C660-0344 |
| Compound Name: | N-cyclopentyl-3-methyl-4-oxo-N-[(thiophen-2-yl)methyl]-4,6,7,8,9,10-hexahydrothieno[2',3':4,5]pyrimido[1,2-a]azepine-2-carboxamide |
| Molecular Weight: | 441.61 |
| Molecular Formula: | C23 H27 N3 O2 S2 |
| Smiles: | Cc1c2C(N3CCCCCC3=Nc2sc1C(N(Cc1cccs1)C1CCCC1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3433 |
| logD: | 4.3433 |
| logSw: | -4.2501 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.191 |
| InChI Key: | BJQYOTJIXGZIPG-UHFFFAOYSA-N |