1,9-dimethyl-N-[2-(methylsulfanyl)phenyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Chemical Structure Depiction of
1,9-dimethyl-N-[2-(methylsulfanyl)phenyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
1,9-dimethyl-N-[2-(methylsulfanyl)phenyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide
Compound characteristics
| Compound ID: | E201-0331 |
| Compound Name: | 1,9-dimethyl-N-[2-(methylsulfanyl)phenyl]-4-oxo-1,4-dihydropyrido[1,2-a]pyrrolo[2,3-d]pyrimidine-2-carboxamide |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | CC1=CC=CN2C1=Nc1c(cc(C(Nc3ccccc3SC)=O)n1C)C2=O |
| Stereo: | ACHIRAL |
| logP: | 2.9851 |
| logD: | 2.9841 |
| logSw: | -3.548 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.817 |
| InChI Key: | OQMHJEUQRHCQTG-UHFFFAOYSA-N |