RefChem:1053368
TL;DR: RefChem:1053368 (CAS 57942-33-3) is a chemical compound with molecular formula C25H30ClN5O2 and molecular weight 467.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-N-[7-chloro-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine
Also Known As: 1,4-Pentanediamine, N(sup 4)-(7-chloro-2-(2-(4-nitrophenyl)ethenyl)-4- quinazolinyl)-N(sup 1),N(sup 1)-diethyl-, 1,4-Pentanediamine, N(sup 4)-(7-chloro-2-(2-(4-nitrophenyl)ethenyl)-4-quinazolinyl)-N(sup 1),N(sup 1)-diethyl-, 4-N-[7-chloro-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine, RefChem:1053368, BRN 0771824
| Molecular Formula | C25H30ClN5O2 |
|---|---|
| Molecular Weight | 467.21 g/mol |
| LogP | 6.2842 |
| Topological Polar Surface Area | 84.19 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 467.2088 |
| Heavy Atoms | 33 |
| Complexity | 1113.7305 |
Chemical Identifiers
| CAS Number | 57942-33-3 |
|---|---|
| SMILES | CCN(CC)CCCC(C)NC1=NC(=NC2=C1C=CC(=C2)Cl)/C=C/C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
RefChem:1053368 (CAS 57942-33-3), with molecular formula C25H30ClN5O2 and molecular weight 467.21 g/mol. IUPAC: 4-N-[7-chloro-2-[(E)-2-(4-nitrophenyl)ethenyl]quinazolin-4-yl]-1-N,1-N-diethylpentane-1,4-diamine.
Chemical Property Profile of RefChem:1053368
Property Insights of RefChem:1053368
The XLogP value of 6.2842 indicates that RefChem:1053368 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.19 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1053368. Following Lipinski's Rule of Five, RefChem:1053368 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1053368?
The CAS number of RefChem:1053368 is 57942-33-3.
What is the molecular formula of RefChem:1053368?
The molecular formula of RefChem:1053368 is C25H30ClN5O2.
What is the molecular weight of RefChem:1053368?
The molecular weight of RefChem:1053368 is 467.21 g/mol.
Where can I buy RefChem:1053368?
You can request a quote for RefChem:1053368 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1053368?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1053368 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.