11-(4-bromophenyl)-2,3,4,5-tetrahydrocyclohepta[c]furo[3,2-g][1]benzopyran-6(1H)-one
Chemical Structure Depiction of
11-(4-bromophenyl)-2,3,4,5-tetrahydrocyclohepta[c]furo[3,2-g][1]benzopyran-6(1H)-one
11-(4-bromophenyl)-2,3,4,5-tetrahydrocyclohepta[c]furo[3,2-g][1]benzopyran-6(1H)-one
Compound characteristics
| Compound ID: | D143-0534 |
| Compound Name: | 11-(4-bromophenyl)-2,3,4,5-tetrahydrocyclohepta[c]furo[3,2-g][1]benzopyran-6(1H)-one |
| Molecular Weight: | 409.28 |
| Molecular Formula: | C22 H17 Br O3 |
| Smiles: | C1CCC2=C(CC1)c1cc3c(coc3cc1OC2=O)c1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 6.642 |
| logD: | 6.642 |
| logSw: | -6.2748 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 30.6998 |
| InChI Key: | SWEHIQSERCNLLW-UHFFFAOYSA-N |