RefChem:108255
TL;DR: RefChem:108255 (CAS 72906-37-7) is a chemical compound with molecular formula C30H26N2O5S and molecular weight 526.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,8-dimethyl-12-(4-methylanilino)-8-azoniapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-14-one;methyl sulfate
Also Known As: 9H-Naphth(3,2,1-kl)acridinium, 2,5-dimethyl-8-((4-methylphenyl)amino)-9-oxo-, methyl sulfate, 2,5-Dimethyl-8-((4-methylphenyl)amino)-9-oxo-9H-naphth(3,2,1-kl)acridinium methyl sulphate, 9H-Naphth(3,2,1-kl)acridinium, 2,5-dimethyl-8-((4-methylphenyl)amino)-9-oxo-, methyl sulfate (1:1), 9H-Naphth[3,2,1-kl]acridinium, 2,5-dimethyl-8-[(4-methylphenyl)amino]-9-oxo-, methyl sulfate (1:1), 2,5-dimethyl-8-[(4-methylphenyl)amino]-9-oxo-9H-naphth[3,2,1-kl]acridinium methyl sulphate
| Molecular Formula | C30H26N2O5S |
|---|---|
| Molecular Weight | 526.16 g/mol |
| LogP | 5.48234 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 526.15625 |
| Heavy Atoms | 38 |
| Complexity | 790.0 |
Chemical Identifiers
| CAS Number | 72906-37-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NC2=C3C4=C(C5=CC=CC=C5C3=O)C6=C(C=CC(=C6)C)[N+](=C4C=C2)C.COS(=O)(=O)[O-] |
| InChIKey | WNIMWYLNYNFEFO-UHFFFAOYSA-N |
Product Overview
RefChem:108255 (CAS 72906-37-7), with molecular formula C30H26N2O5S and molecular weight 526.16 g/mol. IUPAC: 4,8-dimethyl-12-(4-methylanilino)-8-azoniapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-1(21),2(7),3,5,8,10,12,15,17,19-decaen-14-one;methyl sulfate.
Chemical Property Profile of RefChem:108255
Property Insights of RefChem:108255
The XLogP value of 5.48234 indicates that RefChem:108255 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:108255. Following Lipinski's Rule of Five, RefChem:108255 has 1 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 RefChem:108255?
The CAS number of RefChem:108255 is 72906-37-7.
What is the molecular formula of RefChem:108255?
The molecular formula of RefChem:108255 is C30H26N2O5S.
What is the molecular weight of RefChem:108255?
The molecular weight of RefChem:108255 is 526.16 g/mol.
Where can I buy RefChem:108255?
You can request a quote for RefChem:108255 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:108255?
Yes, KEHONG BIO provides custom synthesis services for RefChem:108255 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.