3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,9-dimethyl-7H-furo[3,2-g][1]benzopyran-7-one
Chemical Structure Depiction of
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,9-dimethyl-7H-furo[3,2-g][1]benzopyran-7-one
3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,9-dimethyl-7H-furo[3,2-g][1]benzopyran-7-one
Compound characteristics
| Compound ID: | Y040-9250 |
| Compound Name: | 3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-5,9-dimethyl-7H-furo[3,2-g][1]benzopyran-7-one |
| Molecular Weight: | 362.38 |
| Molecular Formula: | C22 H18 O5 |
| Smiles: | CC1=CC(=O)Oc2c1cc1c(coc1c2C)c1ccc2c(c1)OCCCO2 |
| Stereo: | ACHIRAL |
| logP: | 3.9876 |
| logD: | 3.9876 |
| logSw: | -4.2456 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 46.005 |
| InChI Key: | DRSUSHJGGMHTET-UHFFFAOYSA-N |