N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide
TL;DR: N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide (CAS 316139-01-2) is a chemical compound with molecular formula C18H16Cl2N4O6 and molecular weight 454.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N'-bis(4-chloro-3-nitrophenyl)hexanediamide
Also Known As: N,N'-bis(4-chloro-3-nitrophenyl)hexanediamide, N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide, N,N'-bis(4-chloro-3-nitro-phenyl)hexanediamide, N~1~,N~6~-Bis(4-chloro-3-nitrophenyl)hexanediamide, N-(4-chloro-3-nitrophenyl)-N'-(4-chloro-3-nitrophenyl)hexane-1,6-diamide
| Molecular Formula | C18H16Cl2N4O6 |
|---|---|
| Molecular Weight | 454.04 g/mol |
| LogP | 4.9474 |
| Topological Polar Surface Area | 144.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 454.04468 |
| Heavy Atoms | 30 |
| Complexity | 919.137 |
Chemical Identifiers
| CAS Number | 316139-01-2 |
|---|---|
| SMILES | C1=CC(=C(C=C1NC(=O)CCCCC(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-])[N+](=O)[O-])Cl |
Product Overview
N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide (CAS 316139-01-2), with molecular formula C18H16Cl2N4O6 and molecular weight 454.04 g/mol. IUPAC: N,N'-bis(4-chloro-3-nitrophenyl)hexanediamide.
Chemical Property Profile of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide
Property Insights of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide
The XLogP value of 4.9474 indicates that N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 144.48 Ų indicates high polarity, suggesting N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide has 2 hydrogen bond donor(s) and 6 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 N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide?
The CAS number of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide is 316139-01-2.
What is the molecular formula of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide?
The molecular formula of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide is C18H16Cl2N4O6.
What is the molecular weight of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide?
The molecular weight of N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide is 454.04 g/mol.
Where can I buy N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide?
You can request a quote for N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide?
Yes, KEHONG BIO provides custom synthesis services for N1,N6-Bis(4-chloro-3-nitrophenyl)hexanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.