1,4-Bis-Boc-1,4,7-triazaheptane
TL;DR: 1,4-Bis-Boc-1,4,7-triazaheptane (CAS 120131-72-8) is a chemical compound with molecular formula C14H29N3O4 and molecular weight 303.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl N-(2-aminoethyl)-N-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]carbamate
Also Known As: 1,4-Bis-Boc-1,4,7-triazaheptane, tert-Butyl (2-aminoethyl)(2-((tert-butoxycarbonyl)amino)ethyl)carbamate, 4631AH, Tert-butyl N-(2-aminoethyl)-N-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]carbamate, K-1421
| Molecular Formula | C14H29N3O4 |
|---|---|
| Molecular Weight | 303.22 g/mol |
| LogP | 1.7069 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 303.21582 |
| Heavy Atoms | 21 |
| Complexity | 345.10873 |
Chemical Identifiers
| CAS Number | 120131-72-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NCCN(CCN)C(=O)OC(C)(C)C |
Product Overview
1,4-Bis-Boc-1,4,7-triazaheptane (CAS 120131-72-8), with molecular formula C14H29N3O4 and molecular weight 303.22 g/mol. IUPAC: tert-butyl N-(2-aminoethyl)-N-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethyl]carbamate.
Chemical Property Profile of 1,4-Bis-Boc-1,4,7-triazaheptane
Property Insights of 1,4-Bis-Boc-1,4,7-triazaheptane
The XLogP value of 1.7069 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Bis-Boc-1,4,7-triazaheptane. The TPSA of 93.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4-Bis-Boc-1,4,7-triazaheptane. Following Lipinski's Rule of Five, 1,4-Bis-Boc-1,4,7-triazaheptane 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 1,4-Bis-Boc-1,4,7-triazaheptane?
The CAS number of 1,4-Bis-Boc-1,4,7-triazaheptane is 120131-72-8.
What is the molecular formula of 1,4-Bis-Boc-1,4,7-triazaheptane?
The molecular formula of 1,4-Bis-Boc-1,4,7-triazaheptane is C14H29N3O4.
What is the molecular weight of 1,4-Bis-Boc-1,4,7-triazaheptane?
The molecular weight of 1,4-Bis-Boc-1,4,7-triazaheptane is 303.22 g/mol.
Where can I buy 1,4-Bis-Boc-1,4,7-triazaheptane?
You can request a quote for 1,4-Bis-Boc-1,4,7-triazaheptane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4-Bis-Boc-1,4,7-triazaheptane?
Yes, KEHONG BIO provides custom synthesis services for 1,4-Bis-Boc-1,4,7-triazaheptane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.