SM 255
TL;DR: SM 255 (CAS 379-85-1) is a chemical compound with molecular formula C30H42Br2N2O2 and molecular weight 620.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
SM 255
8-[[4-[4-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]phenyl]phenyl]methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol dibromide
Also Known As: SM 255, Biphenylene-(4,4')-bis-methyl-(3-alpha-hydroxy)-tropaniumbromide [German], Biphenylene-(4,4')-bis-methyl-(3-alpha-hydroxy)-tropaniumbromide, 1-alpha-H,5-alpha-H-Tropanium, 4,4'-biphenylenebis(3-alpha-hydroxy-8-methyl-, dibromide, 8,8'-[[1,1'-Biphenyl]-4,4'-diylbis(methylene)]bis(3-hydroxy-8-methyl-8-azabicyclo[3.2.1]octan-8-ium) dibromide
| Molecular Formula | C30H42Br2N2O2 |
|---|---|
| Molecular Weight | 620.16 g/mol |
| LogP | -1.37 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 622.15924 |
| Heavy Atoms | 36 |
| Complexity | 623.0 |
Chemical Identifiers
| CAS Number | 379-85-1 |
|---|---|
| SMILES | C[N+]1(C2CCC1CC(C2)O)CC3=CC=C(C=C3)C4=CC=C(C=C4)C[N+]5(C6CCC5CC(C6)O)C.[Br-].[Br-] |
| InChIKey | PVEXJVCUKXRDSU-UHFFFAOYSA-L |
Product Overview
SM 255 (CAS 379-85-1), with molecular formula C30H42Br2N2O2 and molecular weight 620.16 g/mol. IUPAC: 8-[[4-[4-[(3-hydroxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl)methyl]phenyl]phenyl]methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-ol dibromide.
Chemical Property Profile of SM 255
Property Insights of SM 255
The XLogP value of -1.37 indicates that SM 255 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 40.5 Ų, SM 255 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SM 255 has 2 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 SM 255?
The CAS number of SM 255 is 379-85-1.
What is the molecular formula of SM 255?
The molecular formula of SM 255 is C30H42Br2N2O2.
What is the molecular weight of SM 255?
The molecular weight of SM 255 is 620.16 g/mol.
Where can I buy SM 255?
You can request a quote for SM 255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SM 255?
Yes, KEHONG BIO provides custom synthesis services for SM 255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.