2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(4-chlorophenyl)ethyl]-N,N,5-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(4-chlorophenyl)ethyl]-N,N,5-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(4-chlorophenyl)ethyl]-N,N,5-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K285-5147 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-[2-(4-chlorophenyl)ethyl]-N,N,5-trimethyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 604.97 |
| Molecular Formula: | C26 H23 Br Cl N3 O3 S2 |
| Smiles: | Cc1c2C(N(CCc3ccc(cc3)[Cl])C(=Nc2sc1C(N(C)C)=O)SCC(c1ccc(cc1)[Br])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2412 |
| logD: | 5.2412 |
| logSw: | -5.9402 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 54.899 |
| InChI Key: | GNAWTBDJQBHOKX-UHFFFAOYSA-N |