ICR 351
TL;DR: ICR 351 (CAS 50641-13-9) is a chemical compound with molecular formula C23H31Cl5N4O and molecular weight 554.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N',N'-bis(2-chloroethyl)propane-1,3-diamine;dihydrochloride
Also Known As: ICR 351, 1,3-Propanediamine, N'-(2-butoxy-7-chlorobenzo(b)-1,5-naphthyridin-10-yl)-N,N-bis(2-chloroethyl)-, dihydrochloride, hydrate, n'-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-n,n-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride, 3-[(2-Butoxy-7-chlorobenzo[b][1,5]naphthyridin-10(5H)-ylidene)amino]-N,N-bis(2-chloroethyl)propan-1-amine--hydrogen chloride (1/2), N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N',N'-bis(2-chloroethyl)propane-1,3-diamine dihydrochloride
| Molecular Formula | C23H31Cl5N4O |
|---|---|
| Molecular Weight | 554.09 g/mol |
| LogP | 7.0405 |
| Topological Polar Surface Area | 50.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 13 |
| Exact Mass | 554.09406 |
| Heavy Atoms | 33 |
| Complexity | 497.0 |
Chemical Identifiers
| CAS Number | 50641-13-9 |
|---|---|
| SMILES | CCCCOC1=NC2=C(C3=C(C=C(C=C3)Cl)N=C2C=C1)NCCCN(CCCl)CCCl.Cl.Cl |
| InChIKey | VUWDQMAHILTTFE-UHFFFAOYSA-N |
Product Overview
ICR 351 (CAS 50641-13-9), with molecular formula C23H31Cl5N4O and molecular weight 554.09 g/mol. IUPAC: N-(2-butoxy-7-chlorobenzo[b][1,5]naphthyridin-10-yl)-N',N'-bis(2-chloroethyl)propane-1,3-diamine;dihydrochloride.
Chemical Property Profile of ICR 351
Property Insights of ICR 351
The XLogP value of 7.0405 indicates that ICR 351 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 351 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ICR 351 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 351?
The CAS number of ICR 351 is 50641-13-9.
What is the molecular formula of ICR 351?
The molecular formula of ICR 351 is C23H31Cl5N4O.
What is the molecular weight of ICR 351?
The molecular weight of ICR 351 is 554.09 g/mol.
Where can I buy ICR 351?
You can request a quote for ICR 351 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ICR 351?
Yes, KEHONG BIO provides custom synthesis services for ICR 351 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.