Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-
TL;DR: Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- (CAS 63754-93-8) is a chemical compound with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-chloro-3-methyl-N-(2-methylbut-3-yn-2-yl)-2-prop-2-ynoxybenzamide
Also Known As: Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-, 5-Chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)benzamide, O-Propargyl, N-(dimethyl-1',1' propyne-2') chlor-5 orthocresotinamide [French], O-Propargyl, N-(dimethyl-1',1' propyne-2') chlor-5 orthocresotinamide, 5-chloro-3-methyl-N-(2-methylbut-3-yn-2-yl)-2-prop-2-ynoxybenzamide
| Molecular Formula | C16H16ClNO2 |
|---|---|
| Molecular Weight | 289.09 g/mol |
| LogP | 2.80202 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 289.08694 |
| Heavy Atoms | 20 |
| Complexity | 606.1285 |
Chemical Identifiers
| CAS Number | 63754-93-8 |
|---|---|
| SMILES | CC1=CC(=CC(=C1OCC#C)C(=O)NC(C)(C)C#C)Cl |
Product Overview
Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- (CAS 63754-93-8), with molecular formula C16H16ClNO2 and molecular weight 289.09 g/mol. IUPAC: 5-chloro-3-methyl-N-(2-methylbut-3-yn-2-yl)-2-prop-2-ynoxybenzamide.
Chemical Property Profile of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-
Property Insights of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-
The XLogP value of 2.80202 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-. With a topological polar surface area (TPSA) of 38.33 Ų, Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- 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 Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-?
The CAS number of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- is 63754-93-8.
What is the molecular formula of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-?
The molecular formula of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- is C16H16ClNO2.
What is the molecular weight of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-?
The molecular weight of Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- is 289.09 g/mol.
Where can I buy Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-?
You can request a quote for Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)-?
Yes, KEHONG BIO provides custom synthesis services for Benzamide, 5-chloro-N-(1,1-dimethyl-2-propynyl)-3-methyl-2-(2-propynyloxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.