TL;DR: Dimethyl Adipimidate (CAS 13139-70-3) is a chemical compound with molecular formula C8H16N2O2 and molecular weight 172.12119 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dimethyl hexanediimidate
Also Known As: Dimethyl adipimidate, dimethyl hexanediimidate, Dimethyl adipinamidate, Dimethyl Adipimate, Adipimate, Dimethyl
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H16N2O2 |
| Molecular Weight | 172.12119 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 66.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 172.12119 Da |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
| SMILES | COC(=N)CCCCC(=N)OC |
| InChIKey | ZLFRJHOBQVVTOJ-UHFFFAOYSA-N |
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl Adipimidate. The TPSA of 66.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl Adipimidate. Following Lipinski's Rule of Five, Dimethyl Adipimidate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dimethyl Adipimidate is 13139-70-3.
The molecular formula of Dimethyl Adipimidate is C8H16N2O2.
The molecular weight of Dimethyl Adipimidate is 172.12119 g/mol.
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