N-{4-[chloro(difluoro)methoxy]phenyl}-2-({7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-{4-[chloro(difluoro)methoxy]phenyl}-2-({7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide
N-{4-[chloro(difluoro)methoxy]phenyl}-2-({7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | 8012-5436 |
| Compound Name: | N-{4-[chloro(difluoro)methoxy]phenyl}-2-({7-[(2-chlorophenyl)methyl]-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl}sulfanyl)acetamide |
| Molecular Weight: | 570.4 |
| Molecular Formula: | C23 H19 Cl2 F2 N5 O4 S |
| Smiles: | CN1C(c2c(nc(n2Cc2ccccc2[Cl])SCC(Nc2ccc(cc2)OC(F)(F)[Cl])=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4704 |
| logD: | 5.4704 |
| logSw: | -5.8448 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.661 |
| InChI Key: | YNSKYSGHHFIOAQ-UHFFFAOYSA-N |