RefChem:859880
TL;DR: RefChem:859880 (CAS 66037-08-9) is a chemical compound with molecular formula C40H63ClN4O5S and molecular weight 746.42 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino-4,4-dimethyl-3-oxopentanamide
Also Known As: Pentanamide, N-(2-chloro-5-((hexadecylsulfonyl)amino)phenyl)-2-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,4-dimethyl-3-oxo-, Pentanamide, N-[2-chloro-5-[(hexadecylsulfonyl)amino]phenyl]-2-[[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino]-4,4-dimethyl-3-oxo-, N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino-4,4-dimethyl-3-oxopentanamide, (Z)-N-(2-chloro-5-(hexadecylsulfonamido)phenyl)-2-((4-(ethyl(2-hydroxyethyl)amino)-2-methylphenyl)imino)-4,4-dimethyl-3-oxopentanamide, N-[2-CHLORO-5-(HEXADECANE-1-SULFONAMIDO)PHENYL]-2-({4-[ETHYL(2-HYDROXYETHYL)AMINO]-2-METHYLPHENYL}IMINO)-4,4-DIMETHYL-3-OXOPENTANAMIDE
| Molecular Formula | C40H63ClN4O5S |
|---|---|
| Molecular Weight | 746.42 g/mol |
| LogP | 10.01642 |
| Topological Polar Surface Area | 128.17 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 25 |
| Exact Mass | 746.4208 |
| Heavy Atoms | 51 |
| Complexity | 1521.1741 |
Chemical Identifiers
| CAS Number | 66037-08-9 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCS(=O)(=O)NC1=CC(=C(C=C1)Cl)NC(=O)C(=NC2=C(C=C(C=C2)N(CC)CCO)C)C(=O)C(C)(C)C |
Product Overview
RefChem:859880 (CAS 66037-08-9), with molecular formula C40H63ClN4O5S and molecular weight 746.42 g/mol. IUPAC: N-[2-chloro-5-(hexadecylsulfonylamino)phenyl]-2-[4-[ethyl(2-hydroxyethyl)amino]-2-methylphenyl]imino-4,4-dimethyl-3-oxopentanamide.
Chemical Property Profile of RefChem:859880
Property Insights of RefChem:859880
The XLogP value of 10.01642 indicates that RefChem:859880 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 128.17 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:859880. Following Lipinski's Rule of Five, RefChem:859880 has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:859880?
The CAS number of RefChem:859880 is 66037-08-9.
What is the molecular formula of RefChem:859880?
The molecular formula of RefChem:859880 is C40H63ClN4O5S.
What is the molecular weight of RefChem:859880?
The molecular weight of RefChem:859880 is 746.42 g/mol.
Where can I buy RefChem:859880?
You can request a quote for RefChem:859880 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:859880?
Yes, KEHONG BIO provides custom synthesis services for RefChem:859880 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.