2-氰基-N-(3,4-二氯苯基)乙酰胺
TL;DR: 2-氰基-N-(3,4-二氯苯基)乙酰胺 (CAS 15386-80-8) is a chemical compound with molecular formula C9H6Cl2N2O and molecular weight 227.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氰基-N-(3,4-二氯苯基)乙酰胺
2-cyano-N-(3,4-dichlorophenyl)acetamide
Also Known As: 2-Cyano-N-(3,4-dichlorophenyl)acetamide, cyanodichlorophenylacetamide, N-(3,4-dichlorophenyl)-2-cyanoacetamide, Acetamide, 2-cyano-N-(3,4-dichlorophenyl)-, 2-Cyano-N-(3,4-dichlorophenyl)-acetamide
| Molecular Formula | C9H6Cl2N2O |
|---|---|
| Molecular Weight | 227.99 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.98572 |
| Heavy Atoms | 14 |
| Complexity | 261.0 |
Chemical Identifiers
| CAS Number | 15386-80-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)CC#N)Cl)Cl |
| InChIKey | HXXDPDIVNQZPCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氰基-N-(3,4-二氯苯基)乙酰胺 (CAS 15386-80-8), with molecular formula C9H6Cl2N2O and molecular weight 227.99 g/mol. IUPAC: 2-cyano-N-(3,4-dichlorophenyl)acetamide.
Chemical Property Profile of 2-氰基-N-(3,4-二氯苯基)乙酰胺
Property Insights of 2-氰基-N-(3,4-二氯苯基)乙酰胺
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氰基-N-(3,4-二氯苯基)乙酰胺. With a topological polar surface area (TPSA) of 52.9 Ų, 2-氰基-N-(3,4-二氯苯基)乙酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氰基-N-(3,4-二氯苯基)乙酰胺 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 2-氰基-N-(3,4-二氯苯基)乙酰胺?
The CAS number of 2-氰基-N-(3,4-二氯苯基)乙酰胺 is 15386-80-8.
What is the molecular formula of 2-氰基-N-(3,4-二氯苯基)乙酰胺?
The molecular formula of 2-氰基-N-(3,4-二氯苯基)乙酰胺 is C9H6Cl2N2O.
What is the molecular weight of 2-氰基-N-(3,4-二氯苯基)乙酰胺?
The molecular weight of 2-氰基-N-(3,4-二氯苯基)乙酰胺 is 227.99 g/mol.
Where can I buy 2-氰基-N-(3,4-二氯苯基)乙酰胺?
You can request a quote for 2-氰基-N-(3,4-二氯苯基)乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氰基-N-(3,4-二氯苯基)乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氰基-N-(3,4-二氯苯基)乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.