N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide
TL;DR: N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide (CAS 349396-57-2) is a chemical compound with molecular formula C14H13Cl2N3O2 and molecular weight 325.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide
Also Known As: N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide, BIM-0018698.P001, 4-(2,4-dichlorophenoxy)-N,N-bis(cyanomethyl)butanamide
| Molecular Formula | C14H13Cl2N3O2 |
|---|---|
| Molecular Weight | 325.04 g/mol |
| LogP | 3.02816 |
| Topological Polar Surface Area | 77.12 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.03848 |
| Heavy Atoms | 21 |
| Complexity | 562.5623 |
Chemical Identifiers
| CAS Number | 349396-57-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1Cl)Cl)OCCCC(=O)N(CC#N)CC#N |
Product Overview
N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide (CAS 349396-57-2), with molecular formula C14H13Cl2N3O2 and molecular weight 325.04 g/mol. IUPAC: N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide.
Chemical Property Profile of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide
Property Insights of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide
The XLogP value of 3.02816 indicates that N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 77.12 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide. Following Lipinski's Rule of Five, N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide has 0 hydrogen bond donor(s) and 4 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 N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide?
The CAS number of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide is 349396-57-2.
What is the molecular formula of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide?
The molecular formula of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide is C14H13Cl2N3O2.
What is the molecular weight of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide?
The molecular weight of N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide is 325.04 g/mol.
Where can I buy N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide?
You can request a quote for N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-bis(cyanomethyl)-4-(2,4-dichlorophenoxy)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.