EINECS 261-840-3
TL;DR: EINECS 261-840-3 (CAS 59651-54-6) is a chemical compound with molecular formula C37H40N6O10S2 and molecular weight 792.22473 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[3-cyclohexyl-5-[5-[1-cyclohexyl-2,4,6-trioxo-3-(2-sulfamoylphenyl)-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-2,4,6-trioxo-1,3-diazinan-1-yl]benzenesulfonamide
Also Known As: 2-(5-(5-(1-(2-(Aminosulphonyl)phenyl)-3-cyclohexyl-1,2,3,4-tetrahydro-6-hydroxy-2,4-dioxo-5-pyrimidinyl)penta-2,4-dienylidene)-3-cyclohexyltetrahydro-2,4,6-trioxo-1(2H)-pyrimidinyl)benzenesulphonamide, 2-(3-Cyclohexyl-5-{5-[1-cyclohexyl-2,4,6-trioxo-3-(2-sulfamoylphenyl)-1,3-diazinan-5-ylidene]penta-1,3-dien-1-yl}-2,4,6-trioxo-1,3-diazinan-1-yl)benzene-1-sulfonamide, 2-[3-cyclohexyl-5-[5-[1-cyclohexyl-2,4,6-trioxo-3-(2-sulfamoylphenyl)-1,3-diazinan-5-ylidene]penta-1,3-dienyl]-2,4,6-trioxo-1,3-diazinan-1-yl]benzenesulfonamide, Benzenesulfonamide,2-[5-[5-[1-[2-(aminosulfonyl)phenyl]-3-cyclohexylhexahydro-2,4,6-trioxo-5-pyrimidinyl]-2,4-pentadienylidene]-3-cyclohexyltetrahydro-2,4,6-trioxo-1(2H)-pyrimidinyl]-(9CI), EINECS 261-840-3
Technical Specifications
| Molecular Formula | C37H40N6O10S2 |
| Molecular Weight | 792.22473 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 252.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 792.22473 Da |
| Heavy Atoms | 55 |
| Complexity | 1870.0 |
| SMILES | C1CCC(CC1)N2C(=O)C(C(=O)N(C2=O)C3=CC=CC=C3S(=O)(=O)N)C=CC=CC=C4C(=O)N(C(=O)N(C4=O)C5=CC=CC=C5S(=O)(=O)N)C6CCCCC6 |
| InChIKey | PFJMRTDVGQCDGW-UHFFFAOYSA-N |
Chemical Property Profile of EINECS 261-840-3
Property Insights of EINECS 261-840-3
The XLogP value of 3.8 indicates that EINECS 261-840-3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 252.0 Ų indicates high polarity, suggesting EINECS 261-840-3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, EINECS 261-840-3 has 2 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of EINECS 261-840-3?
The CAS number of EINECS 261-840-3 is 59651-54-6.
What is the molecular formula of EINECS 261-840-3?
The molecular formula of EINECS 261-840-3 is C37H40N6O10S2.
What is the molecular weight of EINECS 261-840-3?
The molecular weight of EINECS 261-840-3 is 792.22473 g/mol.
Where can I buy EINECS 261-840-3?
You can request a quote for EINECS 261-840-3 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for EINECS 261-840-3?
Yes, CoreyChem provides custom synthesis services for EINECS 261-840-3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.