CTK4F9738
TL;DR: CTK4F9738 (CAS 27466-68-8) is a chemical compound with molecular formula C15H21Cl2N7 and molecular weight 369.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-ethyl-1,2,4-triazole-3,4-diamine
Also Known As: 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-ethyl-4H-1,2,4-triazol-4-amine, 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazinyl]-5-ethyl-4H-1,2,4-triazol-4-amine, Benzaldehyde,4-[bis(2-chloroethyl)amino]-,2-(4-amino-5-ethyl-4H-1,2,4-triazol-3-yl)hydrazone, hydrochloride (1:1)
| Molecular Formula | C15H21Cl2N7 |
|---|---|
| Molecular Weight | 369.12 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 369.12354 |
| Heavy Atoms | 24 |
| Complexity | 371.0 |
Chemical Identifiers
| CAS Number | 27466-68-8 |
|---|---|
| SMILES | CCC1=NN=C(N1N)NN=CC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | AXTAZNORBMNKOU-UHFFFAOYSA-N |
Product Overview
CTK4F9738 (CAS 27466-68-8), with molecular formula C15H21Cl2N7 and molecular weight 369.12 g/mol. IUPAC: 3-N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-ethyl-1,2,4-triazole-3,4-diamine.
Chemical Property Profile of CTK4F9738
Property Insights of CTK4F9738
The XLogP value of 3.3 indicates that CTK4F9738 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for CTK4F9738. Following Lipinski's Rule of Five, CTK4F9738 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 CTK4F9738?
The CAS number of CTK4F9738 is 27466-68-8.
What is the molecular formula of CTK4F9738?
The molecular formula of CTK4F9738 is C15H21Cl2N7.
What is the molecular weight of CTK4F9738?
The molecular weight of CTK4F9738 is 369.12 g/mol.
Where can I buy CTK4F9738?
You can request a quote for CTK4F9738 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK4F9738?
Yes, KEHONG BIO provides custom synthesis services for CTK4F9738 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.