methyl 2-[(5-chloropentanamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylate
Chemical Structure Depiction of
methyl 2-[(5-chloropentanamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylate
methyl 2-[(5-chloropentanamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylate
Compound characteristics
| Compound ID: | V011-6260 |
| Compound Name: | methyl 2-[(5-chloropentanamido)methyl]-2,3-dihydro-1-benzofuran-5-carboxylate |
| Molecular Weight: | 325.79 |
| Molecular Formula: | C16 H20 Cl N O4 |
| Smiles: | COC(c1ccc2c(CC(CNC(CCCC[Cl])=O)O2)c1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2885 |
| logD: | 2.2885 |
| logSw: | -2.8939 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.48 |
| InChI Key: | YKOOBDREKHPMJE-CYBMUJFWSA-N |