3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-7H-furo[3,2-g][1]benzopyran-7-one
Chemical Structure Depiction of
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-7H-furo[3,2-g][1]benzopyran-7-one
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-7H-furo[3,2-g][1]benzopyran-7-one
Compound characteristics
| Compound ID: | Y040-9251 |
| Compound Name: | 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5-methyl-7H-furo[3,2-g][1]benzopyran-7-one |
| Molecular Weight: | 348.35 |
| Molecular Formula: | C21 H16 O5 |
| Smiles: | CC1=CC(=O)Oc2cc3c(cc12)c(co3)c1ccc2c(c1)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.5746 |
| logD: | 3.5746 |
| logSw: | -3.7425 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.088 |
| InChI Key: | UQINBEKYHKSEDT-UHFFFAOYSA-N |