2-[(2S)-7-oxo-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-2-yl]propan-2-yl 2,4-dichlorobenzoate
Chemical Structure Depiction of
2-[(2S)-7-oxo-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-2-yl]propan-2-yl 2,4-dichlorobenzoate
2-[(2S)-7-oxo-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-2-yl]propan-2-yl 2,4-dichlorobenzoate
Compound characteristics
| Compound ID: | N005-0007 |
| Compound Name: | 2-[(2S)-7-oxo-2,3-dihydro-7H-furo[3,2-g][1]benzopyran-2-yl]propan-2-yl 2,4-dichlorobenzoate |
| Molecular Weight: | 419.26 |
| Molecular Formula: | C21 H16 Cl2 O5 |
| Smiles: | CC(C)([C@@H]1Cc2cc3C=CC(=O)Oc3cc2O1)OC(c1ccc(cc1[Cl])[Cl])=O |
| Stereo: | ABSOLUTE |
| logP: | 5.3895 |
| logD: | 5.3895 |
| logSw: | -5.9658 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 47.577 |
| InChI Key: | TUEJOWGKTTYSKR-SFHVURJKSA-N |