N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-[2-(cycloheptylamino)-1-(3-methoxy-4-propoxyphenyl)-2-oxoethyl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-[2-(cycloheptylamino)-1-(3-methoxy-4-propoxyphenyl)-2-oxoethyl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-[2-(cycloheptylamino)-1-(3-methoxy-4-propoxyphenyl)-2-oxoethyl]acetamide
Compound characteristics
| Compound ID: | K784-6376 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-chloro-N-[2-(cycloheptylamino)-1-(3-methoxy-4-propoxyphenyl)-2-oxoethyl]acetamide |
| Molecular Weight: | 545.08 |
| Molecular Formula: | C29 H37 Cl N2 O6 |
| Smiles: | CCCOc1ccc(cc1OC)C(C(NC1CCCCCC1)=O)N(Cc1ccc2c(c1)OCO2)C(C[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3478 |
| logD: | 5.3478 |
| logSw: | -5.4488 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.626 |
| InChI Key: | SGCNZMBYDLZWOU-MUUNZHRXSA-N |