3-(3,4-dichlorophenyl)-N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
3-(3,4-dichlorophenyl)-N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
3-(3,4-dichlorophenyl)-N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K305-0243 |
| Compound Name: | 3-(3,4-dichlorophenyl)-N,N-diethyl-5-methyl-2,4-dioxo-1-{2-oxo-2-[(2-phenylethyl)amino]ethyl}-1,2,3,4-tetrahydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 587.52 |
| Molecular Formula: | C28 H28 Cl2 N4 O4 S |
| Smiles: | CCN(CC)C(c1c(C)c2C(N(C(N(CC(NCCc3ccccc3)=O)c2s1)=O)c1ccc(c(c1)[Cl])[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2988 |
| logD: | 4.2988 |
| logSw: | -4.7577 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.352 |
| InChI Key: | KOABEWKRLCWCFK-UHFFFAOYSA-N |