Desfluoro Lapatinib
TL;DR: Desfluoro Lapatinib (CAS 231277-91-1) is a chemical compound with molecular formula C29H27ClN4O4S and molecular weight 562.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-4-phenylmethoxyphenyl)-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine
Also Known As: Desfluoro Lapatinib, Lapatinib Impurity 6, Lapatinib Impurity 8, Lapatinib Impurity 16, GW574783B
| Molecular Formula | C29H27ClN4O4S |
|---|---|
| Molecular Weight | 562.14 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 106.35 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 11 |
| Exact Mass | 562.14417 |
| Heavy Atoms | 39 |
| Complexity | 1690.701 |
Chemical Identifiers
| CAS Number | 231277-91-1 |
|---|---|
| SMILES | CS(=O)(=O)CCNCC1=CC=C(O1)C2=CC3=C(C=C2)N=CN=C3NC4=CC(=C(C=C4)OCC5=CC=CC=C5)Cl |
Product Overview
Desfluoro Lapatinib (CAS 231277-91-1), with molecular formula C29H27ClN4O4S and molecular weight 562.14 g/mol. IUPAC: N-(3-chloro-4-phenylmethoxyphenyl)-6-[5-[(2-methylsulfonylethylamino)methyl]furan-2-yl]quinazolin-4-amine.
Chemical Property Profile of Desfluoro Lapatinib
Property Insights of Desfluoro Lapatinib
The XLogP value of 6.0 indicates that Desfluoro Lapatinib is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.35 Ų falls within the moderate polarity range, balancing permeability and solubility for Desfluoro Lapatinib. Following Lipinski's Rule of Five, Desfluoro Lapatinib has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Desfluoro Lapatinib?
The CAS number of Desfluoro Lapatinib is 231277-91-1.
What is the molecular formula of Desfluoro Lapatinib?
The molecular formula of Desfluoro Lapatinib is C29H27ClN4O4S.
What is the molecular weight of Desfluoro Lapatinib?
The molecular weight of Desfluoro Lapatinib is 562.14 g/mol.
Where can I buy Desfluoro Lapatinib?
You can request a quote for Desfluoro Lapatinib directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Desfluoro Lapatinib?
Yes, KEHONG BIO provides custom synthesis services for Desfluoro Lapatinib and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.