2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate
TL;DR: 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate (CAS 72745-12-1) is a chemical compound with molecular formula C21H31NO6 and molecular weight 393.21515 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(benzylamino)-3-cycloheptyloxypropan-2-ol;(E)-but-2-enedioic acid
Also Known As: 1-Benzylamino-3-cycloheptyloxy-2-propanol maleate, 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate, 1-Cycloheptyloxy-3-benzylamino-2-propanol hydrogenmaleat, 1-Cycloheptyloxy-3-benzylamino-2-propanol hydrogenmaleat [German], 1-(benzylamino)-3-cycloheptyloxypropan-2-ol; (E)-but-2-enedioic acid
Technical Specifications
| Molecular Formula | C21H31NO6 |
| Molecular Weight | 393.21515 g/mol |
| XLogP | 2.5883 |
| Topological Polar Surface Area (TPSA) | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 393.21515 Da |
| Heavy Atoms | 28 |
| Complexity | 352.0 |
| SMILES | C1CCCC(CC1)OCC(CNCC2=CC=CC=C2)O.C(=C/C(=O)O)\C(=O)O |
| InChIKey | GFTNKIPUWNRHDV-WLHGVMLRSA-N |
Chemical Property Profile of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate
Property Insights of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate
The XLogP value of 2.5883 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate. Following Lipinski's Rule of Five, 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate has 4 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate?
The CAS number of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate is 72745-12-1.
What is the molecular formula of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate?
The molecular formula of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate is C21H31NO6.
What is the molecular weight of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate?
The molecular weight of 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate is 393.21515 g/mol.
Where can I buy 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate?
You can request a quote for 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate?
Yes, CoreyChem provides custom synthesis services for 2-Propanol, 1-benzylamino-3-cycloheptyloxy-, maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.