N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methoxyethyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methoxyethyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methoxyethyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C280-0914 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[3-(2-methoxyethyl)-6-methyl-4-oxo-3,4,6,7-tetrahydrothieno[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 435.52 |
| Molecular Formula: | C19 H21 N3 O5 S2 |
| Smiles: | CC1CC2=C(C(N(CCOC)C(=N2)SCC(Nc2ccc3c(c2)OCO3)=O)=O)S1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1935 |
| logD: | 2.1934 |
| logSw: | -2.9406 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.965 |
| InChI Key: | APHYOSSAEYTLTB-NSHDSACASA-N |