![3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine structure](/static/products/274/27466-67-7.png)
3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
TL;DR: 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine (CAS 27466-67-7) is a chemical compound with molecular formula C14H19Cl2N7 and molecular weight 355.11 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-methyl-1,2,4-triazole-3,4-diamine
Also Known As: 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine, 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazinyl]-5-methyl-4H-1,2,4-triazol-4-amine, 3-N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine, Benzaldehyde,4-[bis(2-chloroethyl)amino]-,2-(4-amino-5-methyl-4H-1,2,4-triazol-3-yl)hydrazone, hydrochloride (1:1)
| Molecular Formula | C14H19Cl2N7 |
|---|---|
| Molecular Weight | 355.11 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 84.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 355.1079 |
| Heavy Atoms | 23 |
| Complexity | 357.0 |
Chemical Identifiers
| CAS Number | 27466-67-7 |
|---|---|
| SMILES | CC1=NN=C(N1N)NN=CC2=CC=C(C=C2)N(CCCl)CCCl |
| InChIKey | DGBKMHFVOWRWBQ-UHFFFAOYSA-N |
Product Overview
3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine (CAS 27466-67-7), with molecular formula C14H19Cl2N7 and molecular weight 355.11 g/mol. IUPAC: 3-N-[[4-[bis(2-chloroethyl)amino]phenyl]methylideneamino]-5-methyl-1,2,4-triazole-3,4-diamine.
Chemical Property Profile of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
Property Insights of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine. The TPSA of 84.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine. Following Lipinski's Rule of Five, 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine 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 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine?
The CAS number of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine is 27466-67-7.
What is the molecular formula of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine?
The molecular formula of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine is C14H19Cl2N7.
What is the molecular weight of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine?
The molecular weight of 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine is 355.11 g/mol.
Where can I buy 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine?
You can request a quote for 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 3-[2-({4-[Bis(2-chloroethyl)amino]phenyl}methylidene)hydrazin-1-yl]-5-methyl-4H-1,2,4-triazol-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.