S-benzyl-N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-cysteine
Chemical Structure Depiction of
S-benzyl-N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-cysteine
S-benzyl-N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-cysteine
Compound characteristics
| Compound ID: | Y041-1746 |
| Compound Name: | S-benzyl-N-{[3-(4-fluorophenyl)-5-methyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-cysteine |
| Molecular Weight: | 545.59 |
| Molecular Formula: | C30 H24 F N O6 S |
| Smiles: | CC1=C(CC(N[C@H](CSCc2ccccc2)C(O)=O)=O)C(=O)Oc2cc3c(cc12)c(co3)c1ccc(cc1)F |
| Stereo: | ABSOLUTE |
| logP: | 4.3688 |
| logD: | 0.0139 |
| logSw: | -4.3475 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.687 |
| InChI Key: | KXNGENNAHPKZOM-VWLOTQADSA-N |