N-[(4-butyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-leucine
Chemical Structure Depiction of
N-[(4-butyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-leucine
N-[(4-butyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-leucine
Compound characteristics
| Compound ID: | Y042-8708 |
| Compound Name: | N-[(4-butyl-7-hydroxy-2-oxo-2H-1-benzopyran-8-yl)methyl]-L-leucine |
| Molecular Weight: | 361.44 |
| Molecular Formula: | C20 H27 N O5 |
| Smiles: | CCCCC1=CC(=O)Oc2c1ccc(c2CN[C@@H](CC(C)C)C(O)=O)O |
| Stereo: | ABSOLUTE |
| logP: | 2.7113 |
| logD: | -0.0147 |
| logSw: | -3.209 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 76.745 |
| InChI Key: | QEKIVQJVRWDTOQ-INIZCTEOSA-N |