ICR 386
TL;DR: ICR 386 (CAS 31529-29-0) is a chemical compound with molecular formula C25H35Cl5N4O and molecular weight 582.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-1-N,1-N-bis(2-chloroethyl)pentane-1,4-diamine;dihydrochloride
Also Known As: ICR 386, ICR 340OH, ICR386, 1,4-Pentanediamine, N(sup 4)-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N(sup 1),N(sup 1)-bis(2-chloroethyl)-, dihydrochloride, n4-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-n1,n1-bis(2-chloroethyl)pentane-1,4-diamine dihydrochloride
| Molecular Formula | C25H35Cl5N4O |
|---|---|
| Molecular Weight | 582.13 g/mol |
| LogP | 7.8191 |
| Topological Polar Surface Area | 50.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 582.12537 |
| Heavy Atoms | 35 |
| Complexity | 540.0 |
Chemical Identifiers
| CAS Number | 31529-29-0 |
|---|---|
| SMILES | CCCCOC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NC(C)CCCN(CCCl)CCCl.Cl.Cl |
| InChIKey | RPYIDXCHRLHNQT-UHFFFAOYSA-N |
Product Overview
ICR 386 (CAS 31529-29-0), with molecular formula C25H35Cl5N4O and molecular weight 582.13 g/mol. IUPAC: 4-N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-1-N,1-N-bis(2-chloroethyl)pentane-1,4-diamine;dihydrochloride.
Chemical Property Profile of ICR 386
Property Insights of ICR 386
The XLogP value of 7.8191 indicates that ICR 386 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.3 Ų, ICR 386 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ICR 386 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ICR 386?
The CAS number of ICR 386 is 31529-29-0.
What is the molecular formula of ICR 386?
The molecular formula of ICR 386 is C25H35Cl5N4O.
What is the molecular weight of ICR 386?
The molecular weight of ICR 386 is 582.13 g/mol.
Where can I buy ICR 386?
You can request a quote for ICR 386 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ICR 386?
Yes, KEHONG BIO provides custom synthesis services for ICR 386 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.