![1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- structure](/static/products/3368/33682-99-4.webp)
1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-
TL;DR: 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- (CAS 33682-99-4) is a chemical compound with molecular formula C13H9ClN4 and molecular weight 256.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(benzotriazol-1-yl)-1-(3-chlorophenyl)methanimine
Also Known As: 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-, N-(benzotriazol-1-yl)-1-(3-chlorophenyl)methanimine, N-(1H-1,2,3-benzotriazol-1-yl)-1-(3-chlorophenyl)methanimine
| Molecular Formula | C13H9ClN4 |
|---|---|
| Molecular Weight | 256.05 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 256.05157 |
| Heavy Atoms | 18 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 33682-99-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=NN2N=CC3=CC(=CC=C3)Cl |
| InChIKey | LMYYNYZBEKYYJF-UHFFFAOYSA-N |
Product Overview
1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- (CAS 33682-99-4), with molecular formula C13H9ClN4 and molecular weight 256.05 g/mol. IUPAC: N-(benzotriazol-1-yl)-1-(3-chlorophenyl)methanimine.
Chemical Property Profile of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-
Property Insights of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-
The XLogP value of 3.5 indicates that 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.1 Ų, 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- has 0 hydrogen bond donor(s) and 3 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 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-?
The CAS number of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- is 33682-99-4.
What is the molecular formula of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-?
The molecular formula of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- is C13H9ClN4.
What is the molecular weight of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-?
The molecular weight of 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- is 256.05 g/mol.
Where can I buy 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-?
You can request a quote for 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Benzotriazole, 1-[(m-chlorobenzylidene)amino]- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.