BAS 00664159
TL;DR: BAS 00664159 (CAS 389074-01-5) is a chemical compound with molecular formula C22H22Cl3N5O3S and molecular weight 541.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[2,2,2-trichloro-1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethyl]benzamide
Also Known As: BAS 00664159, F0170-0571, 4-methyl-N-[2,2,2-trichloro-1-({4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl}amino)ethyl]benzamide, 4-methyl-N-(2,2,2-trichloro-1-((4-(N-(4,6-dimethylpyrimidin-2-yl)sulfamoyl)phenyl)amino)ethyl)benzamide, 4-methyl-N-[2,2,2-trichloro-1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethyl]benzamide
| Molecular Formula | C22H22Cl3N5O3S |
|---|---|
| Molecular Weight | 541.05 g/mol |
| LogP | 4.74086 |
| Topological Polar Surface Area | 113.08 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 541.0509 |
| Heavy Atoms | 34 |
| Complexity | 1258.3824 |
Chemical Identifiers
| CAS Number | 389074-01-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NC(C(Cl)(Cl)Cl)NC2=CC=C(C=C2)S(=O)(=O)NC3=NC(=CC(=N3)C)C |
Product Overview
BAS 00664159 (CAS 389074-01-5), with molecular formula C22H22Cl3N5O3S and molecular weight 541.05 g/mol. IUPAC: 4-methyl-N-[2,2,2-trichloro-1-[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]anilino]ethyl]benzamide.
Chemical Property Profile of BAS 00664159
Property Insights of BAS 00664159
The XLogP value of 4.74086 indicates that BAS 00664159 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.08 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00664159. Following Lipinski's Rule of Five, BAS 00664159 has 3 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 BAS 00664159?
The CAS number of BAS 00664159 is 389074-01-5.
What is the molecular formula of BAS 00664159?
The molecular formula of BAS 00664159 is C22H22Cl3N5O3S.
What is the molecular weight of BAS 00664159?
The molecular weight of BAS 00664159 is 541.05 g/mol.
Where can I buy BAS 00664159?
You can request a quote for BAS 00664159 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00664159?
Yes, KEHONG BIO provides custom synthesis services for BAS 00664159 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.