N-{[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-phenylalanine
Chemical Structure Depiction of
N-{[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-phenylalanine
N-{[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-phenylalanine
Compound characteristics
| Compound ID: | Y041-2150 |
| Compound Name: | N-{[5-methyl-3-(4-methylphenyl)-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl]acetyl}-D-phenylalanine |
| Molecular Weight: | 495.53 |
| Molecular Formula: | C30 H25 N O6 |
| Smiles: | CC1=C(CC(N[C@H](Cc2ccccc2)C(O)=O)=O)C(=O)Oc2cc3c(cc12)c(co3)c1ccc(C)cc1 |
| Stereo: | ABSOLUTE |
| logP: | 4.3298 |
| logD: | 0.7392 |
| logSw: | -4.3474 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.687 |
| InChI Key: | KRICIHIHWBROPF-RUZDIDTESA-N |