KST-1A0702
TL;DR: KST-1A0702 (CAS 115044-39-8) is a chemical compound with molecular formula C24H17Cl3N4 and molecular weight 466.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-N-(4-chlorophenyl)-3,6-bis[(4-chlorophenyl)imino]cyclohexa-1,4-diene-1,4-diamine
Also Known As: KST-1A0702, (3e,6e)-n-(4-chlorophenyl)-3,6-bis[(4-chlorophenyl)imino]cyclohexa-1,4-diene-1,4-diamine, 1,4-Cyclohexadiene-1,4-diamine, N-(4-chlorophenyl)-3,6-bis(4-chlorophenyl)imino)-, 1-N-(4-chlorophenyl)-3,6-bis[(4-chlorophenyl)imino]cyclohexa-1,4-diene-1,4-diamine, N'-(4-chlorophenyl)-3,6-bis[(4-chlorophenyl)imino]cyclohexa-1,4-diene-1,4-diamine
| Molecular Formula | C24H17Cl3N4 |
|---|---|
| Molecular Weight | 466.05 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.05188 |
| Heavy Atoms | 31 |
| Complexity | 736.0 |
Chemical Identifiers
| CAS Number | 115044-39-8 |
|---|---|
| SMILES | C1=CC(=CC=C1NC2=CC(=NC3=CC=C(C=C3)Cl)C(=CC2=NC4=CC=C(C=C4)Cl)N)Cl |
| InChIKey | FCMWEZXEXNPTGH-UHFFFAOYSA-N |
Product Overview
KST-1A0702 (CAS 115044-39-8), with molecular formula C24H17Cl3N4 and molecular weight 466.05 g/mol. IUPAC: 1-N-(4-chlorophenyl)-3,6-bis[(4-chlorophenyl)imino]cyclohexa-1,4-diene-1,4-diamine.
Chemical Property Profile of KST-1A0702
Property Insights of KST-1A0702
The XLogP value of 6.9 indicates that KST-1A0702 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for KST-1A0702. Following Lipinski's Rule of Five, KST-1A0702 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of KST-1A0702?
The CAS number of KST-1A0702 is 115044-39-8.
What is the molecular formula of KST-1A0702?
The molecular formula of KST-1A0702 is C24H17Cl3N4.
What is the molecular weight of KST-1A0702?
The molecular weight of KST-1A0702 is 466.05 g/mol.
Where can I buy KST-1A0702?
You can request a quote for KST-1A0702 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for KST-1A0702?
Yes, KEHONG BIO provides custom synthesis services for KST-1A0702 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.