N-(2H-1,3-benzodioxol-5-yl)-2-({1-[(furan-2-yl)methyl]-2-oxo-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-({1-[(furan-2-yl)methyl]-2-oxo-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-({1-[(furan-2-yl)methyl]-2-oxo-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | G857-0374 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-({1-[(furan-2-yl)methyl]-2-oxo-2,5,6,7-tetrahydro-1H-cyclopenta[d]pyrimidin-4-yl}sulfanyl)acetamide |
| Molecular Weight: | 425.46 |
| Molecular Formula: | C21 H19 N3 O5 S |
| Smiles: | C1CC2=C(C1)N(Cc1ccco1)C(N=C2SCC(Nc1ccc2c(c1)OCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9061 |
| logD: | 2.9061 |
| logSw: | -3.3478 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.499 |
| InChI Key: | RDNIYOMVGYFHBQ-UHFFFAOYSA-N |