EINECS 263-587-4
TL;DR: EINECS 263-587-4 (CAS 63040-88-0) is a chemical compound with molecular formula C18H19Br2N5O7S and molecular weight 606.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-4-(2,3-dibromopropanoylamino)benzenesulfonic acid
Also Known As: EINECS 263-587-4, 4,5-Pyrimidinedione, 2-amino-1,6-dihydro-6-methyl-, 2-((5-Carbamoyl-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridyl)azo)-4-((2,3-dibromo-1-oxopropyl)amino)benzenesulphonic acid, Benzenesulfonic acid, 2-((5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl)azo)-4-((2,3-dibromo-1-oxopropyl)amino)-, Benzenesulfonic acid,2-[2-[5-(aminocarbonyl)-1-ethyl-1,6-dihydro-2-hydroxy-4-methyl-6-oxo-3-pyridinyl]diazenyl]-4-[(2,3-dibromo-1-oxopropyl)amino]-
| Molecular Formula | C18H19Br2N5O7S |
|---|---|
| Molecular Weight | 606.94 g/mol |
| LogP | 2.74012 |
| Topological Polar Surface Area | 193.51 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 606.9372 |
| Heavy Atoms | 33 |
| Complexity | 1308.2374 |
Chemical Identifiers
| CAS Number | 63040-88-0 |
|---|---|
| SMILES | CCN1C(=C(C(=C(C1=O)N=NC2=C(C=CC(=C2)NC(=O)C(CBr)Br)S(=O)(=O)O)C)C(=O)N)O |
Product Overview
EINECS 263-587-4 (CAS 63040-88-0), with molecular formula C18H19Br2N5O7S and molecular weight 606.94 g/mol. IUPAC: 2-[(5-carbamoyl-1-ethyl-6-hydroxy-4-methyl-2-oxo-3-pyridinyl)diazenyl]-4-(2,3-dibromopropanoylamino)benzenesulfonic acid.
Chemical Property Profile of EINECS 263-587-4
Property Insights of EINECS 263-587-4
The XLogP value of 2.74012 suggests moderate lipophilicity, balancing water solubility and membrane permeability for EINECS 263-587-4. The TPSA of 193.51 Ų indicates high polarity, suggesting EINECS 263-587-4 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 263-587-4 has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of EINECS 263-587-4?
The CAS number of EINECS 263-587-4 is 63040-88-0.
What is the molecular formula of EINECS 263-587-4?
The molecular formula of EINECS 263-587-4 is C18H19Br2N5O7S.
What is the molecular weight of EINECS 263-587-4?
The molecular weight of EINECS 263-587-4 is 606.94 g/mol.
Where can I buy EINECS 263-587-4?
You can request a quote for EINECS 263-587-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for EINECS 263-587-4?
Yes, KEHONG BIO provides custom synthesis services for EINECS 263-587-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.