BAS 06856696
TL;DR: BAS 06856696 (CAS 461402-52-8) is a chemical compound with molecular formula C19H14Cl2N2O3S and molecular weight 420.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenyl]furan-2-carboxamide
Also Known As: BAS 06856696, BRD-K13857225-001-01-0, N-(2-chloro-4-(2-((4-chlorophenyl)thio)acetamido)phenyl)furan-2-carboxamide, N-[2-chloro-4-({[(4-chlorophenyl)sulfanyl]acetyl}amino)phenyl]furan-2-carboxamide, N-[2-chloro-4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenyl]furan-2-carboxamide
| Molecular Formula | C19H14Cl2N2O3S |
|---|---|
| Molecular Weight | 420.01 g/mol |
| LogP | 5.5695 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.01022 |
| Heavy Atoms | 27 |
| Complexity | 944.09845 |
Chemical Identifiers
| CAS Number | 461402-52-8 |
|---|---|
| SMILES | C1=COC(=C1)C(=O)NC2=C(C=C(C=C2)NC(=O)CSC3=CC=C(C=C3)Cl)Cl |
Product Overview
BAS 06856696 (CAS 461402-52-8), with molecular formula C19H14Cl2N2O3S and molecular weight 420.01 g/mol. IUPAC: N-[2-chloro-4-[[2-(4-chlorophenyl)sulfanylacetyl]amino]phenyl]furan-2-carboxamide.
Chemical Property Profile of BAS 06856696
Property Insights of BAS 06856696
The XLogP value of 5.5695 indicates that BAS 06856696 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 06856696. Following Lipinski's Rule of Five, BAS 06856696 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of BAS 06856696?
The CAS number of BAS 06856696 is 461402-52-8.
What is the molecular formula of BAS 06856696?
The molecular formula of BAS 06856696 is C19H14Cl2N2O3S.
What is the molecular weight of BAS 06856696?
The molecular weight of BAS 06856696 is 420.01 g/mol.
Where can I buy BAS 06856696?
You can request a quote for BAS 06856696 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 06856696?
Yes, KEHONG BIO provides custom synthesis services for BAS 06856696 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.