ethyl 3-{6-chloro-7-[2-(diethylamino)-2-oxoethoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Chemical Structure Depiction of
ethyl 3-{6-chloro-7-[2-(diethylamino)-2-oxoethoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
ethyl 3-{6-chloro-7-[2-(diethylamino)-2-oxoethoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate
Compound characteristics
| Compound ID: | Y040-7896 |
| Compound Name: | ethyl 3-{6-chloro-7-[2-(diethylamino)-2-oxoethoxy]-4-methyl-2-oxo-2H-1-benzopyran-3-yl}propanoate |
| Molecular Weight: | 423.89 |
| Molecular Formula: | C21 H26 Cl N O6 |
| Smiles: | CCN(CC)C(COc1cc2c(cc1[Cl])C(C)=C(CCC(=O)OCC)C(=O)O2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6069 |
| logD: | 3.6069 |
| logSw: | -3.9818 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.309 |
| InChI Key: | HEXCSEFOPCOPDM-UHFFFAOYSA-N |