N-butyl-1,3-diaminopropane
TL;DR: N-butyl-1,3-diaminopropane (CAS 6935-60-0) is a chemical compound with molecular formula C7H18N2 and molecular weight 130.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-butylpropane-1,3-diamine
Also Known As: spermidine, N-Bdap, N-Butyl-1,3-diaminopropane, N-Butyl-1,3-propanediamine, N'-butylpropane-1,3-diamine
| Molecular Formula | C7H18N2 |
|---|---|
| Molecular Weight | 130.15 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 130.147 |
| Heavy Atoms | 9 |
| Complexity | 46.0 |
Chemical Identifiers
| CAS Number | 6935-60-0 |
|---|---|
| SMILES | CCCCNCCCN |
| InChIKey | MIFWXJNZWLWCGL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 16 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-butyl-1,3-diaminopropane (CAS 6935-60-0), with molecular formula C7H18N2 and molecular weight 130.15 g/mol. IUPAC: N'-butylpropane-1,3-diamine.
Chemical Property Profile of N-butyl-1,3-diaminopropane
Property Insights of N-butyl-1,3-diaminopropane
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-1,3-diaminopropane. With a topological polar surface area (TPSA) of 38.1 Ų, N-butyl-1,3-diaminopropane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-1,3-diaminopropane has 2 hydrogen bond donor(s) and 2 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 N-butyl-1,3-diaminopropane?
The CAS number of N-butyl-1,3-diaminopropane is 6935-60-0.
What is the molecular formula of N-butyl-1,3-diaminopropane?
The molecular formula of N-butyl-1,3-diaminopropane is C7H18N2.
What is the molecular weight of N-butyl-1,3-diaminopropane?
The molecular weight of N-butyl-1,3-diaminopropane is 130.15 g/mol.
Where can I buy N-butyl-1,3-diaminopropane?
You can request a quote for N-butyl-1,3-diaminopropane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-1,3-diaminopropane?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-1,3-diaminopropane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.