2-(thiophen-2-yl)-N-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}acetamide
Chemical Structure Depiction of
2-(thiophen-2-yl)-N-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}acetamide
2-(thiophen-2-yl)-N-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}acetamide
Compound characteristics
| Compound ID: | C301-8801 |
| Compound Name: | 2-(thiophen-2-yl)-N-{2-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]phenyl}acetamide |
| Molecular Weight: | 441.53 |
| Molecular Formula: | C20 H19 N5 O3 S2 |
| Smiles: | CN1C(c2c(nc(n2C)Sc2ccccc2NC(Cc2cccs2)=O)N(C)C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6553 |
| logD: | 2.6553 |
| logSw: | -3.1277 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.295 |
| InChI Key: | PSWSERALUHJVCD-UHFFFAOYSA-N |