N-[6-(2-chloroacetamido)hexyl]-4-hydroxy-2-oxo-2H-1-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-[6-(2-chloroacetamido)hexyl]-4-hydroxy-2-oxo-2H-1-benzopyran-3-carboxamide
N-[6-(2-chloroacetamido)hexyl]-4-hydroxy-2-oxo-2H-1-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | 0672-0476 |
| Compound Name: | N-[6-(2-chloroacetamido)hexyl]-4-hydroxy-2-oxo-2H-1-benzopyran-3-carboxamide |
| Molecular Weight: | 380.83 |
| Molecular Formula: | C18 H21 Cl N2 O5 |
| Smiles: | C(CCCNC(C1=C(c2ccccc2OC1=O)O)=O)CCNC(C[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 0.7865 |
| logD: | -3.222 |
| logSw: | -2.1899 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 85.071 |
| InChI Key: | YUTYIHKTUKMBPY-UHFFFAOYSA-N |