2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one
TL;DR: 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one (CAS 5436-08-8) is a chemical compound with molecular formula C21H26BrNO and molecular weight 387.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one
Also Known As: 2-bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one
| Molecular Formula | C21H26BrNO |
|---|---|
| Molecular Weight | 387.12 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 387.11978 |
| Heavy Atoms | 24 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 5436-08-8 |
|---|---|
| SMILES | CC(C(=O)C(CCCN(C)C)(C1=CC=CC=C1)C2=CC=CC=C2)Br |
| InChIKey | YYXKJOTWBKSNBS-UHFFFAOYSA-N |
Product Overview
2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one (CAS 5436-08-8), with molecular formula C21H26BrNO and molecular weight 387.12 g/mol. IUPAC: 2-bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one.
Chemical Property Profile of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one
Property Insights of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one
The XLogP value of 5.0 indicates that 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one?
The CAS number of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one is 5436-08-8.
What is the molecular formula of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one?
The molecular formula of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one is C21H26BrNO.
What is the molecular weight of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one?
The molecular weight of 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one is 387.12 g/mol.
Where can I buy 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one?
You can request a quote for 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Bromo-7-(dimethylamino)-4,4-diphenylheptan-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.