4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
TL;DR: 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline (CAS 25313-16-0) is a chemical compound with molecular formula C16H19N3 and molecular weight 253.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
Also Known As: 4-methyl-n-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline, 4-methyl-N-(1,2,3,4-tetrahydro-quinoxalin-2-ylmethyl)-anilin
| Molecular Formula | C16H19N3 |
|---|---|
| Molecular Weight | 253.16 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 36.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 253.1579 |
| Heavy Atoms | 19 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 25313-16-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC2CNC3=CC=CC=C3N2 |
| InChIKey | GEGCIRNHHQBIJJ-UHFFFAOYSA-N |
Product Overview
4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline (CAS 25313-16-0), with molecular formula C16H19N3 and molecular weight 253.16 g/mol. IUPAC: 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline.
Chemical Property Profile of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
Property Insights of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
The XLogP value of 3.8 indicates that 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 36.1 Ų, 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline has 3 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 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline?
The CAS number of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline is 25313-16-0.
What is the molecular formula of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline?
The molecular formula of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline is C16H19N3.
What is the molecular weight of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline?
The molecular weight of 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline is 253.16 g/mol.
Where can I buy 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline?
You can request a quote for 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.