2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate
TL;DR: 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate (CAS 72745-10-9) is a chemical compound with molecular formula C18H31NO5 and molecular weight 341.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-[1-(tert-butylamino)-3-cycloheptyloxypropan-2-yl]oxy-4-oxobut-2-enoic acid
Also Known As: 1-tert-Butylamino-3-cycloheptyloxy-2-propanol maleate, 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate, 1-Cycloheptyloxy-3-tert-butylamino-2-propanol hydrogenmaleat, 1-Cycloheptyloxy-3-tert-butylamino-2-propanol hydrogenmaleat [German], (E)-4-[1-(tert-butylamino)-3-cycloheptyloxypropan-2-yl]oxy-4-oxobut-2-enoic acid
| Molecular Formula | C18H31NO5 |
|---|---|
| Molecular Weight | 341.22 g/mol |
| LogP | 2.6665 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 341.2202 |
| Heavy Atoms | 24 |
| Complexity | 419.6153 |
Chemical Identifiers
| CAS Number | 72745-10-9 |
|---|---|
| SMILES | CC(C)(C)NCC(COC1CCCCCC1)OC(=O)/C=C/C(=O)O |
Product Overview
2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate (CAS 72745-10-9), with molecular formula C18H31NO5 and molecular weight 341.22 g/mol. IUPAC: (E)-4-[1-(tert-butylamino)-3-cycloheptyloxypropan-2-yl]oxy-4-oxobut-2-enoic acid.
Chemical Property Profile of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate
Property Insights of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate
The XLogP value of 2.6665 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate. Following Lipinski's Rule of Five, 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate?
The CAS number of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate is 72745-10-9.
What is the molecular formula of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate?
The molecular formula of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate is C18H31NO5.
What is the molecular weight of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate?
The molecular weight of 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate is 341.22 g/mol.
Where can I buy 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate?
You can request a quote for 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate?
Yes, KEHONG BIO provides custom synthesis services for 2-Propanol, 1-tert-butylamino-3-cycloheptyloxy-, maleate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.