3-(3,4-dimethylphenyl)-N,N-diethyl-5-methyl-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(3,4-dimethylphenyl)-N,N-diethyl-5-methyl-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(3,4-dimethylphenyl)-N,N-diethyl-5-methyl-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0224 |
| Compound Name: | 3-(3,4-dimethylphenyl)-N,N-diethyl-5-methyl-1-[(6-methyl-4-oxo-4H-pyrido[1,2-a]pyrimidin-2-yl)methyl]-2,4-dioxo-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 557.67 |
| Molecular Formula: | C30 H31 N5 O4 S |
| Smiles: | CCN(CC)C(c1c(C)c2C(N(C(N(CC3=CC(N4C(C)=CC=CC4=N3)=O)c2s1)=O)c1ccc(C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9096 |
| logD: | 3.9096 |
| logSw: | -4.1095 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 72.69 |
| InChI Key: | CQCPHQYMEQUFCN-UHFFFAOYSA-N |