4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺
TL;DR: 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 (CAS 98841-62-4) is a chemical compound with molecular formula C17H18ClNO3 and molecular weight 319.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺
4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide
Also Known As: Maybridge1_005175, 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide, 4-Chloro-N-(3,4-dimethoxyphenethyl)benzamide, N-(3,4-dimethoxyphenethyl)-4-chlorobenzamide, Benzamide, 4-chloro-N-(3,4-dimethoxyphenethyl)-
| Molecular Formula | C17H18ClNO3 |
|---|---|
| Molecular Weight | 319.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.09753 |
| Heavy Atoms | 22 |
| Complexity | 345.0 |
Chemical Identifiers
| CAS Number | 98841-62-4 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCNC(=O)C2=CC=C(C=C2)Cl)OC |
| InChIKey | XIALHRNGCMHQJS-UHFFFAOYSA-N |
Product Overview
4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 (CAS 98841-62-4), with molecular formula C17H18ClNO3 and molecular weight 319.10 g/mol. IUPAC: 4-chloro-N-[2-(3,4-dimethoxyphenyl)ethyl]benzamide.
Chemical Property Profile of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺
Property Insights of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺
The XLogP value of 3.3 indicates that 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 has 1 hydrogen bond donor(s) and 3 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 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺?
The CAS number of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 is 98841-62-4.
What is the molecular formula of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺?
The molecular formula of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 is C17H18ClNO3.
What is the molecular weight of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺?
The molecular weight of 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 is 319.10 g/mol.
Where can I buy 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺?
You can request a quote for 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 4-氯-N-(3,4-二甲氧基苯乙基)苯甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.