2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-[3-(propylsulfanyl)propyl]acetamide
Chemical Structure Depiction of
2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-[3-(propylsulfanyl)propyl]acetamide
2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-[3-(propylsulfanyl)propyl]acetamide
Compound characteristics
| Compound ID: | F509-0486 |
| Compound Name: | 2-[7-(4-chlorophenyl)-5,6-dimethyl-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-3-yl]-N-[3-(propylsulfanyl)propyl]acetamide |
| Molecular Weight: | 447 |
| Molecular Formula: | C22 H27 Cl N4 O2 S |
| Smiles: | [H]C1=Nc2c(C(N1CC(NCCCSCCC)=O)=O)c(C)c(C)n2c1ccc(cc1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.3007 |
| logD: | 3.3007 |
| logSw: | -4.0992 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.25 |
| InChI Key: | FJKBQYHZCPFNRU-UHFFFAOYSA-N |