RefChem:549116
TL;DR: RefChem:549116 (CAS 136203-54-8) is a chemical compound with molecular formula C23H26BrNO2 and molecular weight 427.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
9-(4-bromophenyl)-3,3,6,6-tetramethyl-2,4,5,7,9,10-hexahydroacridine-1,8-dione
Also Known As: ChemDiv1_026587, DivK1c_004331, 9-(4-bromophenyl)-3,3,6,6-tetramethyl-3,4,6,7,9,10-hexahydroacridine-1,8(2H,5H)-dione, CDS1_003291, BAS 00478069
| Molecular Formula | C23H26BrNO2 |
|---|---|
| Molecular Weight | 427.11 g/mol |
| LogP | 5.4223 |
| Topological Polar Surface Area | 46.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 427.1147 |
| Heavy Atoms | 27 |
| Complexity | 850.811 |
Chemical Identifiers
| CAS Number | 136203-54-8 |
|---|---|
| SMILES | CC1(CC2=C(C(C3=C(N2)CC(CC3=O)(C)C)C4=CC=C(C=C4)Br)C(=O)C1)C |
Product Overview
RefChem:549116 (CAS 136203-54-8), with molecular formula C23H26BrNO2 and molecular weight 427.11 g/mol. IUPAC: 9-(4-bromophenyl)-3,3,6,6-tetramethyl-2,4,5,7,9,10-hexahydroacridine-1,8-dione.
Chemical Property Profile of RefChem:549116
Property Insights of RefChem:549116
The XLogP value of 5.4223 indicates that RefChem:549116 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.17 Ų, RefChem:549116 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:549116 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:549116?
The CAS number of RefChem:549116 is 136203-54-8.
What is the molecular formula of RefChem:549116?
The molecular formula of RefChem:549116 is C23H26BrNO2.
What is the molecular weight of RefChem:549116?
The molecular weight of RefChem:549116 is 427.11 g/mol.
Where can I buy RefChem:549116?
You can request a quote for RefChem:549116 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:549116?
Yes, KEHONG BIO provides custom synthesis services for RefChem:549116 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.