N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycine
Chemical Structure Depiction of
N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycine
N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycine
Compound characteristics
| Compound ID: | D715-1158 |
| Compound Name: | N-[3-(6-chloro-7-hydroxy-4-methyl-2-oxo-2H-1-benzopyran-3-yl)propanoyl]glycine |
| Molecular Weight: | 339.73 |
| Molecular Formula: | C15 H14 Cl N O6 |
| Smiles: | CC1=C(CCC(NCC(O)=O)=O)C(=O)Oc2cc(c(cc12)[Cl])O |
| Stereo: | ACHIRAL |
| logP: | 1.0883 |
| logD: | -2.798 |
| logSw: | -2.5355 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 90.563 |
| InChI Key: | ZRCQXXHGJHOLTP-UHFFFAOYSA-N |