SM 305
TL;DR: SM 305 (CAS 337-75-7) is a chemical compound with molecular formula C44H48Br2Cl2N2O4 and molecular weight 896.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
SM 305
[8-[[4-[4-[[3-(4-chlorobenzoyl)oxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl]methyl]phenyl]phenyl]methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 4-chlorobenzoate dibromide
Also Known As: SM 305, Biphenyl-(4,4')-bis-methyl-(3-(p-chlor)benzoyloxy)-tropaniumbromid [German], Biphenyl-(4,4')-bis-methyl-(3-(p-chlor)benzoyloxy)-tropaniumbromid, 1-alpha-H,5-alpha-H-Tropanium, 4,4'-biphenylenebis(3-alpha-hydroxy-8-methyl-, dibromide, p-chlorobenzoate (ester), 8,8'-(biphenyl-4,4'-diyldimethanediyl)bis{3-[(4-chlorobenzoyl)oxy]-8-methyl-8-azoniabicyclo[3.2.1]octane} dibromide
| Molecular Formula | C44H48Br2Cl2N2O4 |
|---|---|
| Molecular Weight | 896.14 g/mol |
| LogP | 3.66 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 11 |
| Exact Mass | 898.1337 |
| Heavy Atoms | 54 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 337-75-7 |
|---|---|
| SMILES | C[N+]1(C2CCC1CC(C2)OC(=O)C3=CC=C(C=C3)Cl)CC4=CC=C(C=C4)C5=CC=C(C=C5)C[N+]6(C7CCC6CC(C7)OC(=O)C8=CC=C(C=C8)Cl)C.[Br-].[Br-] |
| InChIKey | WHDFKCBXUHPBTQ-UHFFFAOYSA-L |
Product Overview
SM 305 (CAS 337-75-7), with molecular formula C44H48Br2Cl2N2O4 and molecular weight 896.14 g/mol. IUPAC: [8-[[4-[4-[[3-(4-chlorobenzoyl)oxy-8-methyl-8-azoniabicyclo[3.2.1]octan-8-yl]methyl]phenyl]phenyl]methyl]-8-methyl-8-azoniabicyclo[3.2.1]octan-3-yl] 4-chlorobenzoate dibromide.
Chemical Property Profile of SM 305
Property Insights of SM 305
The XLogP value of 3.66 indicates that SM 305 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.6 Ų, SM 305 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, SM 305 has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of SM 305?
The CAS number of SM 305 is 337-75-7.
What is the molecular formula of SM 305?
The molecular formula of SM 305 is C44H48Br2Cl2N2O4.
What is the molecular weight of SM 305?
The molecular weight of SM 305 is 896.14 g/mol.
Where can I buy SM 305?
You can request a quote for SM 305 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for SM 305?
Yes, KEHONG BIO provides custom synthesis services for SM 305 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.