3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride
TL;DR: 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride (CAS 63765-86-6) is a chemical compound with molecular formula C22H30ClNO and molecular weight 359.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium chloride
Also Known As: 6-Dimethylamino-4,4-diphenyl-5-methyl-3-hexanone methochloride, 3-HEXANONE, 5-(N,N-DIMETHYLAMINO)METHYL-4,4-DIPHENYL-, METHYLCHLORIDE, trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium chloride, N,N,N,2-Tetramethyl-4-oxo-3,3-diphenylhexan-1-aminium chloride, Benzenepropanaminium, N,N,N,.beta.-tetramethyl-.gamma.-(1-oxopropyl)-.gamma.-phenyl-, chloride
| Molecular Formula | C22H30ClNO |
|---|---|
| Molecular Weight | 359.20 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 359.2016 |
| Heavy Atoms | 25 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 63765-86-6 |
|---|---|
| SMILES | CCC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)C(C)C[N+](C)(C)C.[Cl-] |
| InChIKey | YWYPAAYCGZXQOQ-UHFFFAOYSA-M |
Product Overview
3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride (CAS 63765-86-6), with molecular formula C22H30ClNO and molecular weight 359.20 g/mol. IUPAC: trimethyl-(2-methyl-4-oxo-3,3-diphenylhexyl)azanium chloride.
Chemical Property Profile of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride
Property Insights of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride. With a topological polar surface area (TPSA) of 17.1 Ų, 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride 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 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride?
The CAS number of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride is 63765-86-6.
What is the molecular formula of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride?
The molecular formula of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride is C22H30ClNO.
What is the molecular weight of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride?
The molecular weight of 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride is 359.20 g/mol.
Where can I buy 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride?
You can request a quote for 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Hexanone, 5-(N,N-dimethylamino)methyl-4,4-diphenyl-, methylchloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.