7-bromo-2-(3-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Chemical Structure Depiction of
7-bromo-2-(3-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
7-bromo-2-(3-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione
Compound characteristics
| Compound ID: | C766-0089 |
| Compound Name: | 7-bromo-2-(3-hydroxyphenyl)-3,5-dihydro-4H-[1]benzopyrano[2,3-d]pyrimidine-4-thione |
| Molecular Weight: | 387.25 |
| Molecular Formula: | C17 H11 Br N2 O2 S |
| Smiles: | C1C2=C(N=C(c3cccc(c3)O)NC2=S)Oc2ccc(cc12)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.1965 |
| logD: | 4.1965 |
| logSw: | -4.3298 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 47.252 |
| InChI Key: | CRXRAFGQOBLBQV-UHFFFAOYSA-N |