RefChem:570636
TL;DR: RefChem:570636 (CAS 21811-94-9) is a chemical compound with molecular formula C17H18N4O5S and molecular weight 390.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-hydroxy-5-(methylsulfamoyl)phenyl]diazenyl]-3-oxo-N-phenylbutanamide
Also Known As: 2-((2-Hydroxy-5-((methylamino)sulphonyl)phenyl)azo)-3-oxo-N-phenylbutyramide, 2-((2-Hydroxy-5-(N-methylsulfonamido)phenyl)azo)-N-phenyl-3-oxobutanamide, Butanamide, 2-((2-hydroxy-5-((methylamino)sulfonyl)phenyl)azo)-3-oxo-N-phenyl-, Butanamide, 2-(2-(2-hydroxy-5-((methylamino)sulfonyl)phenyl)diazenyl)-3-oxo-N-phenyl-, Butanamide, 2-[2-[2-hydroxy-5-[(methylamino)sulfonyl]phenyl]diazenyl]-3-oxo-N-phenyl-
| Molecular Formula | C17H18N4O5S |
|---|---|
| Molecular Weight | 390.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.0998 |
| Heavy Atoms | 27 |
| Complexity | 655.0 |
Chemical Identifiers
| CAS Number | 21811-94-9 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC=CC=C1)N=NC2=C(C=CC(=C2)S(=O)(=O)NC)O |
| InChIKey | JDADFXDXAQJCDH-UHFFFAOYSA-N |
Product Overview
RefChem:570636 (CAS 21811-94-9), with molecular formula C17H18N4O5S and molecular weight 390.10 g/mol. IUPAC: 2-[[2-hydroxy-5-(methylsulfamoyl)phenyl]diazenyl]-3-oxo-N-phenylbutanamide.
Chemical Property Profile of RefChem:570636
Property Insights of RefChem:570636
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:570636. The TPSA of 146.0 Ų indicates high polarity, suggesting RefChem:570636 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:570636 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:570636?
The CAS number of RefChem:570636 is 21811-94-9.
What is the molecular formula of RefChem:570636?
The molecular formula of RefChem:570636 is C17H18N4O5S.
What is the molecular weight of RefChem:570636?
The molecular weight of RefChem:570636 is 390.10 g/mol.
Where can I buy RefChem:570636?
You can request a quote for RefChem:570636 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:570636?
Yes, KEHONG BIO provides custom synthesis services for RefChem:570636 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.