2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | K292-1072 |
| Compound Name: | 2-{[2-(4-bromophenyl)-2-oxoethyl]sulfanyl}-3-(4-methoxyphenyl)thieno[3,2-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 487.39 |
| Molecular Formula: | C21 H15 Br N2 O3 S2 |
| Smiles: | COc1ccc(cc1)N1C(=Nc2ccsc2C1=O)SCC(c1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 4.8545 |
| logD: | 4.8545 |
| logSw: | -4.6183 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.969 |
| InChI Key: | AABRUNRYAQCROJ-UHFFFAOYSA-N |