N,N'-dibenzylbutane-1,4-diamine
TL;DR: N,N'-dibenzylbutane-1,4-diamine (CAS 31719-05-8) is a chemical compound with molecular formula C18H24N2 and molecular weight 268.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-dibenzylbutane-1,4-diamine
Also Known As: N,N'-dibenzylbutane-1,4-diamine, N1,N4-Dibenzylbutane-1,4-diamine, N,N'-Dibenzyl-1,4-diamino-butane, n,n'-dibenzyltetramethylenediamine, benzyl[4-(benzylamino)butyl]amine
| Molecular Formula | C18H24N2 |
|---|---|
| Molecular Weight | 268.19 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 24.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 9 |
| Exact Mass | 268.19394 |
| Heavy Atoms | 20 |
| Complexity | 193.0 |
Chemical Identifiers
| CAS Number | 31719-05-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNCCCCNCC2=CC=CC=C2 |
| InChIKey | IXBTYWVCTCYLJR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N'-dibenzylbutane-1,4-diamine (CAS 31719-05-8), with molecular formula C18H24N2 and molecular weight 268.19 g/mol. IUPAC: N,N'-dibenzylbutane-1,4-diamine.
Chemical Property Profile of N,N'-dibenzylbutane-1,4-diamine
Property Insights of N,N'-dibenzylbutane-1,4-diamine
The XLogP value of 3.1 indicates that N,N'-dibenzylbutane-1,4-diamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 24.1 Ų, N,N'-dibenzylbutane-1,4-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N'-dibenzylbutane-1,4-diamine 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,N'-dibenzylbutane-1,4-diamine?
The CAS number of N,N'-dibenzylbutane-1,4-diamine is 31719-05-8.
What is the molecular formula of N,N'-dibenzylbutane-1,4-diamine?
The molecular formula of N,N'-dibenzylbutane-1,4-diamine is C18H24N2.
What is the molecular weight of N,N'-dibenzylbutane-1,4-diamine?
The molecular weight of N,N'-dibenzylbutane-1,4-diamine is 268.19 g/mol.
Where can I buy N,N'-dibenzylbutane-1,4-diamine?
You can request a quote for N,N'-dibenzylbutane-1,4-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N'-dibenzylbutane-1,4-diamine?
Yes, KEHONG BIO provides custom synthesis services for N,N'-dibenzylbutane-1,4-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.