2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(prop-2-en-1-yl)-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-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | 3448-6054 |
| Compound Name: | 2-[(2-bromoprop-2-en-1-yl)sulfanyl]-3-(prop-2-en-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one |
| Molecular Weight: | 397.35 |
| Molecular Formula: | C16 H17 Br N2 O S2 |
| Smiles: | C=CCN1C(=Nc2c(C1=O)c1CCCCc1s2)SCC(=C)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.6855 |
| logD: | 4.6855 |
| logSw: | -4.6492 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.1154 |
| InChI Key: | BYBRSCFMESYOPS-UHFFFAOYSA-N |