7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
TL;DR: 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 375361-84-5) is a chemical compound with molecular formula C12H6ClIN4O3 and molecular weight 415.92 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Also Known As: 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine, 7-chloro-N-(2-iodophenyl)-4-nitrobenzo[c][1,2,5]oxadiazol-5-amine, 5-chloro-N-(2-iodophenyl)-2-nitro-8-oxa-7,9-diazabicyclo[4.3.0]nona-2,4,6,9-tetraen-3-amine
| Molecular Formula | C12H6ClIN4O3 |
|---|---|
| Molecular Weight | 415.92 g/mol |
| LogP | 4.1326 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 415.91733 |
| Heavy Atoms | 21 |
| Complexity | 851.6349 |
Chemical Identifiers
| CAS Number | 375361-84-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)NC2=C(C3=NON=C3C(=C2)Cl)[N+](=O)[O-])I |
Product Overview
7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine (CAS 375361-84-5), with molecular formula C12H6ClIN4O3 and molecular weight 415.92 g/mol. IUPAC: 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine.
Chemical Property Profile of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
Property Insights of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine
The XLogP value of 4.1326 indicates that 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.09 Ų falls within the moderate polarity range, balancing permeability and solubility for 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine. Following Lipinski's Rule of Five, 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine has 1 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 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The CAS number of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is 375361-84-5.
What is the molecular formula of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular formula of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is C12H6ClIN4O3.
What is the molecular weight of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
The molecular weight of 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine is 415.92 g/mol.
Where can I buy 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
You can request a quote for 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine?
Yes, KEHONG BIO provides custom synthesis services for 7-chloro-N-(2-iodophenyl)-4-nitro-2,1,3-benzoxadiazol-5-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.