N-(2H-1,3-benzodioxol-5-yl)-2-({2-oxo-1-[(pyridin-3-yl)methyl]-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-({2-oxo-1-[(pyridin-3-yl)methyl]-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-({2-oxo-1-[(pyridin-3-yl)methyl]-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G857-0372 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({2-oxo-1-[(pyridin-3-yl)methyl]-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 436.49 |
| Molecular Formula: | C22 H20 N4 O4 S |
| Smiles: | C1CC2=C(C1)N(Cc1cccnc1)C(N=C2SCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3395 |
| logD: | 2.3394 |
| logSw: | -2.5821 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.269 |
| InChI Key: | ZVZBMCKTLUBKIH-UHFFFAOYSA-N |