3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione
TL;DR: 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione (CAS 73855-47-7) is a chemical compound with molecular formula C15H13N3S and molecular weight 267.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(benzylamino)-1H-quinoxaline-2-thione
Also Known As: 3-Quinoxalinethiol, 2-benzylamino-, 2-Benzylamino-3-mercaptoquinoxaline, 2-BENZYLAMINO-3-QUINOXALINETHIOL, N(Cc1ccccc1)c2nc3ccccc3nc2S, 3-(benzylamino)-1H-quinoxaline-2-thione
| Molecular Formula | C15H13N3S |
|---|---|
| Molecular Weight | 267.08 g/mol |
| LogP | 3.90449 |
| Topological Polar Surface Area | 40.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 267.083 |
| Heavy Atoms | 19 |
| Complexity | 749.9355 |
Chemical Identifiers
| CAS Number | 73855-47-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=NC3=CC=CC=C3NC2=S |
Product Overview
3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione (CAS 73855-47-7), with molecular formula C15H13N3S and molecular weight 267.08 g/mol. IUPAC: 3-(benzylamino)-1H-quinoxaline-2-thione.
Chemical Property Profile of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione
Property Insights of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione
The XLogP value of 3.90449 indicates that 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.71 Ų, 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione has 2 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-((Phenylmethyl)amino)-2(1H)-quinoxalinethione?
The CAS number of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione is 73855-47-7.
What is the molecular formula of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione?
The molecular formula of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione is C15H13N3S.
What is the molecular weight of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione?
The molecular weight of 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione is 267.08 g/mol.
Where can I buy 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione?
You can request a quote for 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione?
Yes, KEHONG BIO provides custom synthesis services for 3-((Phenylmethyl)amino)-2(1H)-quinoxalinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.