CI 628M
TL;DR: CI 628M (CAS 76313-96-7) is a chemical compound with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(E)-2-nitro-2-phenyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethenyl]phenol
Also Known As: CI 628M, CI628M, CI-628M, 4-[(E)-2-nitro-2-phenyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethenyl]phenol, Phenol, 4-(2-nitro-2-phenyl-1-(4-(2-(1-pyrrolidinyl)ethoxy)phenyl)ethenyl)-
| Molecular Formula | C26H26N2O4 |
|---|---|
| Molecular Weight | 430.19 g/mol |
| LogP | 5.0601 |
| Topological Polar Surface Area | 75.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 430.18927 |
| Heavy Atoms | 32 |
| Complexity | 1071.0745 |
Chemical Identifiers
| CAS Number | 76313-96-7 |
|---|---|
| SMILES | C1CCN(C1)CCOC2=CC=C(C=C2)/C(=C(\C3=CC=CC=C3)/[N+](=O)[O-])/C4=CC=C(C=C4)O |
Product Overview
CI 628M (CAS 76313-96-7), with molecular formula C26H26N2O4 and molecular weight 430.19 g/mol. IUPAC: 4-[(E)-2-nitro-2-phenyl-1-[4-(2-pyrrolidin-1-ylethoxy)phenyl]ethenyl]phenol.
Chemical Property Profile of CI 628M
Property Insights of CI 628M
The XLogP value of 5.0601 indicates that CI 628M is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.84 Ų falls within the moderate polarity range, balancing permeability and solubility for CI 628M. Following Lipinski's Rule of Five, CI 628M has 1 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 CI 628M?
The CAS number of CI 628M is 76313-96-7.
What is the molecular formula of CI 628M?
The molecular formula of CI 628M is C26H26N2O4.
What is the molecular weight of CI 628M?
The molecular weight of CI 628M is 430.19 g/mol.
Where can I buy CI 628M?
You can request a quote for CI 628M directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CI 628M?
Yes, KEHONG BIO provides custom synthesis services for CI 628M and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.