EINECS 303-239-1
TL;DR: EINECS 303-239-1 (CAS 94159-58-7) is a chemical compound with molecular formula C20H22N6O7S and molecular weight 490.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2,5-dimethoxy-4-(methylsulfamoyl)phenyl]diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide
Also Known As: EINECS 303-239-1, N-(2,3-Dihydro-2-oxo-1H-benzimidazol-5-yl)-2-((2,5-dimethoxy-4-((methylamino)sulphonyl)phenyl)azo)-3-oxobutyramide, 2-[[2,5-dimethoxy-4-(methylsulfamoyl)phenyl]diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide, 2-{2-[2,5-dimethoxy-4-(methylsulfamoyl)phenyl]diazen-1-yl}-3-oxo-N-(2-oxo-2,3-dihydro-1H-1,3-benzodiazol-5-yl)butanamide, N-(2,3-dihydro-2-oxo-1H-benzimidazol-5-yl)-2-[[2,5-dimethoxy-4-[(methylamino)sulphonyl]phenyl]azo]-3-oxobutyramide
| Molecular Formula | C20H22N6O7S |
|---|---|
| Molecular Weight | 490.13 g/mol |
| LogP | 1.4615 |
| Topological Polar Surface Area | 184.17 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 490.12708 |
| Heavy Atoms | 34 |
| Complexity | 1441.3535 |
Chemical Identifiers
| CAS Number | 94159-58-7 |
|---|---|
| SMILES | CC(=O)C(C(=O)NC1=CC2=C(C=C1)NC(=O)N2)N=NC3=CC(=C(C=C3OC)S(=O)(=O)NC)OC |
Product Overview
EINECS 303-239-1 (CAS 94159-58-7), with molecular formula C20H22N6O7S and molecular weight 490.13 g/mol. IUPAC: 2-[[2,5-dimethoxy-4-(methylsulfamoyl)phenyl]diazenyl]-3-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)butanamide.
Chemical Property Profile of EINECS 303-239-1
Property Insights of EINECS 303-239-1
The XLogP value of 1.4615 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 303-239-1. The TPSA of 184.17 Ų indicates high polarity, suggesting EINECS 303-239-1 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 303-239-1 has 4 hydrogen bond donor(s) and 9 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 EINECS 303-239-1?
The CAS number of EINECS 303-239-1 is 94159-58-7.
What is the molecular formula of EINECS 303-239-1?
The molecular formula of EINECS 303-239-1 is C20H22N6O7S.
What is the molecular weight of EINECS 303-239-1?
The molecular weight of EINECS 303-239-1 is 490.13 g/mol.
Where can I buy EINECS 303-239-1?
You can request a quote for EINECS 303-239-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 303-239-1?
Yes, KEHONG BIO provides custom synthesis services for EINECS 303-239-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.