K279-1462
TL;DR: K279-1462 (CAS 959544-05-9) is a chemical compound with molecular formula C30H28N6O5S and molecular weight 584.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-ylmethyl)-2-[5-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide
Also Known As: K279-1462, F6548-4054, 2-{[2-({[(2H-1,3-benzodioxol-5-yl)methyl]carbamoyl}methyl)-3-oxo-2H,3H-imidazo[1,2-c]quinazolin-5-yl]sulfanyl}-N-[4-(dimethylamino)phenyl]acetamide, N-(1,3-benzodioxol-5-ylmethyl)-2-[5-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide, 2-[(2-{2-[(1,3-benzodioxol-5-ylmethyl)amino]-2-oxoethyl}-3-oxo-2,3-dihydroimidazo[1,2-c]quinazolin-5-yl)thio]-N-[4-(dimethylamino)phenyl]acetamide
| Molecular Formula | C30H28N6O5S |
|---|---|
| Molecular Weight | 584.18 g/mol |
| LogP | 3.5182 |
| Topological Polar Surface Area | 124.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 584.1842 |
| Heavy Atoms | 42 |
| Complexity | 1620.6158 |
Chemical Identifiers
| CAS Number | 959544-05-9 |
|---|---|
| SMILES | CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C4=NC(C(=O)N42)CC(=O)NCC5=CC6=C(C=C5)OCO6 |
Product Overview
K279-1462 (CAS 959544-05-9), with molecular formula C30H28N6O5S and molecular weight 584.18 g/mol. IUPAC: N-(1,3-benzodioxol-5-ylmethyl)-2-[5-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-3-oxo-2H-imidazo[1,2-c]quinazolin-2-yl]acetamide.
Chemical Property Profile of K279-1462
Property Insights of K279-1462
The XLogP value of 3.5182 indicates that K279-1462 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.93 Ų falls within the moderate polarity range, balancing permeability and solubility for K279-1462. Following Lipinski's Rule of Five, K279-1462 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of K279-1462?
The CAS number of K279-1462 is 959544-05-9.
What is the molecular formula of K279-1462?
The molecular formula of K279-1462 is C30H28N6O5S.
What is the molecular weight of K279-1462?
The molecular weight of K279-1462 is 584.18 g/mol.
Where can I buy K279-1462?
You can request a quote for K279-1462 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for K279-1462?
Yes, KEHONG BIO provides custom synthesis services for K279-1462 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.