7-butoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4H-1-benzopyran-4-one
Chemical Structure Depiction of
7-butoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4H-1-benzopyran-4-one
7-butoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4H-1-benzopyran-4-one
Compound characteristics
| Compound ID: | Y040-4156 |
| Compound Name: | 7-butoxy-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4H-1-benzopyran-4-one |
| Molecular Weight: | 380.44 |
| Molecular Formula: | C23 H24 O5 |
| Smiles: | CCCCOc1ccc2C(C(=C(C)Oc2c1)c1ccc2c(c1)OCCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5724 |
| logD: | 4.5724 |
| logSw: | -4.542 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.898 |
| InChI Key: | ANJZZZUEQBQPJR-UHFFFAOYSA-N |