2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Chemical Structure Depiction of
2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3448-6053 |
| Compound Name: | 2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(4-methoxyphenyl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 463.41 |
| Molecular Formula: | C20 H19 Br N2 O2 S2 |
| Smiles: | COc1ccc(cc1)N1C(=Nc2c(C1=O)c1CCCCc1s2)SCC(=C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.3105 |
| logD: | 5.3105 |
| logSw: | -5.3065 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 32.798 |
| InChI Key: | FUYHCSZJOHLWPJ-UHFFFAOYSA-N |