2-[3-(3,4-dichlorophenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-[3-(3,4-dichlorophenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
2-[3-(3,4-dichlorophenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C242-1061 |
| Compound Name: | 2-[3-(3,4-dichlorophenyl)-5,6-dimethyl-2,4-dioxo-3,4-dihydrothieno[2,3-d]pyrimidin-1(2H)-yl]-N-[(oxolan-2-yl)methyl]acetamide |
| Molecular Weight: | 482.38 |
| Molecular Formula: | C21 H21 Cl2 N3 O4 S |
| Smiles: | Cc1c2C(N(C(N(CC(NCC3CCCO3)=O)c2sc1C)=O)c1ccc(c(c1)[Cl])[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3771 |
| logD: | 3.3771 |
| logSw: | -3.9635 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.233 |
| InChI Key: | DVVKJEYWVHYFIS-CQSZACIVSA-N |