J1.248.848C
TL;DR: J1.248.848C (CAS 7242-44-6) is a chemical compound with molecular formula C24H24Br2N2O4S2 and molecular weight 625.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8,9-dibromo-2,5-bis-(4-methylphenyl)sulfonyl-1,3,4,6-tetrahydro-2,5-benzodiazocine
Also Known As: J1.248.848C, 8,9-Dibromo-2,5-bis(4-methylbenzene-1-sulfonyl)-1,2,3,4,5,6-hexahydro-2,5-benzodiazocine, 1,2,3,4,5,6-Hexahydro-8,9-dibromo-2,5-ditosyl-2,5-benzodiazocine, 10,11-Dibromo-3,6-ditosyl-3,6-diazabicyclo[6.4.0]dodeca-1(8),9,11-triene, 8,9-dibromo-2,5-bis(4-methylbenzenesulfonyl)-1,2,3,4,5,6-hexahydro-2,5-benzodiazocine
| Molecular Formula | C24H24Br2N2O4S2 |
|---|---|
| Molecular Weight | 625.95 g/mol |
| LogP | 5.22384 |
| Topological Polar Surface Area | 74.76 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 625.9544 |
| Heavy Atoms | 34 |
| Complexity | 1312.5448 |
Chemical Identifiers
| CAS Number | 7242-44-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC3=CC(=C(C=C3C2)Br)Br)S(=O)(=O)C4=CC=C(C=C4)C |
Product Overview
J1.248.848C (CAS 7242-44-6), with molecular formula C24H24Br2N2O4S2 and molecular weight 625.95 g/mol. IUPAC: 8,9-dibromo-2,5-bis-(4-methylphenyl)sulfonyl-1,3,4,6-tetrahydro-2,5-benzodiazocine.
Chemical Property Profile of J1.248.848C
Property Insights of J1.248.848C
The XLogP value of 5.22384 indicates that J1.248.848C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.76 Ų falls within the moderate polarity range, balancing permeability and solubility for J1.248.848C. Following Lipinski's Rule of Five, J1.248.848C has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of J1.248.848C?
The CAS number of J1.248.848C is 7242-44-6.
What is the molecular formula of J1.248.848C?
The molecular formula of J1.248.848C is C24H24Br2N2O4S2.
What is the molecular weight of J1.248.848C?
The molecular weight of J1.248.848C is 625.95 g/mol.
Where can I buy J1.248.848C?
You can request a quote for J1.248.848C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for J1.248.848C?
Yes, KEHONG BIO provides custom synthesis services for J1.248.848C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.