methyl 4-(3-amino-5-chloro-1-benzofuran-2-yl)-4-oxobutanoate
Chemical Structure Depiction of
methyl 4-(3-amino-5-chloro-1-benzofuran-2-yl)-4-oxobutanoate
methyl 4-(3-amino-5-chloro-1-benzofuran-2-yl)-4-oxobutanoate
Compound characteristics
| Compound ID: | 8009-2286 |
| Compound Name: | methyl 4-(3-amino-5-chloro-1-benzofuran-2-yl)-4-oxobutanoate |
| Molecular Weight: | 281.69 |
| Molecular Formula: | C13 H12 Cl N O4 |
| Smiles: | COC(CCC(c1c(c2cc(ccc2o1)[Cl])N)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7905 |
| logD: | 2.7904 |
| logSw: | -3.226 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.976 |
| InChI Key: | ALVYWEKGDNMOAE-UHFFFAOYSA-N |