3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride
TL;DR: 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride (CAS 64057-61-0) is a chemical compound with molecular formula C18H18ClNO and molecular weight 299.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)-1-phenanthren-3-ylethanone;hydrochloride
Also Known As: Trimethylamine, phenanthr-3-ylcarbonyl-, hydrochloride, 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride, 3-(2-(Dimethylamino)-1-oxoethyl)phenanthrene hydrochloride, 2-(dimethylamino)-1-(phenanthren-3-yl)ethanone hydrochloride(1:1), 2-(dimethylamino)-1-phenanthren-3-ylethanone hydrochloride
| Molecular Formula | C18H18ClNO |
|---|---|
| Molecular Weight | 299.11 g/mol |
| LogP | 4.16 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.1077 |
| Heavy Atoms | 21 |
| Complexity | 351.0 |
Chemical Identifiers
| CAS Number | 64057-61-0 |
|---|---|
| SMILES | CN(C)CC(=O)C1=CC2=C(C=CC3=CC=CC=C32)C=C1.Cl |
| InChIKey | CJARPGIERZIHNT-UHFFFAOYSA-N |
Product Overview
3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride (CAS 64057-61-0), with molecular formula C18H18ClNO and molecular weight 299.11 g/mol. IUPAC: 2-(dimethylamino)-1-phenanthren-3-ylethanone;hydrochloride.
Chemical Property Profile of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride
Property Insights of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride
The XLogP value of 4.16 indicates that 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride has 1 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-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride?
The CAS number of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride is 64057-61-0.
What is the molecular formula of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride?
The molecular formula of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride is C18H18ClNO.
What is the molecular weight of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride?
The molecular weight of 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride is 299.11 g/mol.
Where can I buy 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride?
You can request a quote for 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenanthrenecarbonylmethylamine, N,N-dimethyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.