![3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline structure](/static/products/438/438538-90-0.png)
3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline
TL;DR: 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline (CAS 438538-90-0) is a chemical compound with molecular formula C14H12Cl2N4 and molecular weight 306.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-dichloro-N-[(5-methylbenzotriazol-1-yl)methyl]aniline
Also Known As: 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline, (3,4-dichlorophenyl)[(5-methylbenzotriazolyl)methyl]amine, 3,4-dichloro-N-[(5-methylbenzotriazol-1-yl)methyl]aniline, 3,4-dichloro-N-[(5-methyl-1,2,3-benzotriazol-1-yl)methyl]aniline
| Molecular Formula | C14H12Cl2N4 |
|---|---|
| Molecular Weight | 306.04 g/mol |
| LogP | 4.11612 |
| Topological Polar Surface Area | 42.74 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 306.0439 |
| Heavy Atoms | 20 |
| Complexity | 766.95496 |
Chemical Identifiers
| CAS Number | 438538-90-0 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N(N=N2)CNC3=CC(=C(C=C3)Cl)Cl |
Product Overview
3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline (CAS 438538-90-0), with molecular formula C14H12Cl2N4 and molecular weight 306.04 g/mol. IUPAC: 3,4-dichloro-N-[(5-methylbenzotriazol-1-yl)methyl]aniline.
Chemical Property Profile of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline
Property Insights of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline
The XLogP value of 4.11612 indicates that 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.74 Ų, 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline has 1 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 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline?
The CAS number of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline is 438538-90-0.
What is the molecular formula of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline?
The molecular formula of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline is C14H12Cl2N4.
What is the molecular weight of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline?
The molecular weight of 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline is 306.04 g/mol.
Where can I buy 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline?
You can request a quote for 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline?
Yes, KEHONG BIO provides custom synthesis services for 3,4-dichloro-N-[(5-methyl-1H-benzotriazol-1-yl)methyl]aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.