1-(4-chlorobenzoyl)-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
Chemical Structure Depiction of
1-(4-chlorobenzoyl)-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
1-(4-chlorobenzoyl)-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one
Compound characteristics
| Compound ID: | 5055-7201 |
| Compound Name: | 1-(4-chlorobenzoyl)-3-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl]azepan-2-one |
| Molecular Weight: | 445.99 |
| Molecular Formula: | C21 H20 Cl N3 O2 S2 |
| Smiles: | Cc1c2c(ncnc2sc1C)SC1CCCCN(C1=O)C(c1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.9657 |
| logD: | 4.9657 |
| logSw: | -5.1466 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.713 |
| InChI Key: | HUIKYYJOYANYKL-INIZCTEOSA-N |