N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-tryptophan
Chemical Structure Depiction of
N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-tryptophan
N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-tryptophan
Compound characteristics
| Compound ID: | Y041-1721 |
| Compound Name: | N-[(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)acetyl]-D-tryptophan |
| Molecular Weight: | 454.87 |
| Molecular Formula: | C23 H19 Cl N2 O6 |
| Smiles: | CC1=C(CC(N[C@H](Cc2c[nH]c3ccccc23)C(O)=O)=O)C(=O)Oc2cc(c(cc12)[Cl])O |
| Stereo: | ABSOLUTE |
| logP: | 2.5879 |
| logD: | -1.0027 |
| logSw: | -3.3213 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 99.817 |
| InChI Key: | XBPODIBQTQBLLU-SFHVURJKSA-N |