![2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine structure](/static/products/673/673446-27-0.png)
2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine
TL;DR: 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine (CAS 673446-27-0) is a chemical compound with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-nitrophenyl)methylsulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine
Also Known As: 2-((4-nitrobenzyl)thio)-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine, 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine, 2-[(4-nitrobenzyl)sulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine, 2-[(4-nitrophenyl)methylsulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine
| Molecular Formula | C18H17N5O2S |
|---|---|
| Molecular Weight | 367.11 g/mol |
| LogP | 3.6863 |
| Topological Polar Surface Area | 107.83 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 367.1103 |
| Heavy Atoms | 26 |
| Complexity | 991.03314 |
Chemical Identifiers
| CAS Number | 673446-27-0 |
|---|---|
| SMILES | C1CCC2=NC3=NC(=NC(=C3C=C2C1)N)SCC4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine (CAS 673446-27-0), with molecular formula C18H17N5O2S and molecular weight 367.11 g/mol. IUPAC: 2-[(4-nitrophenyl)methylsulfanyl]-6,7,8,9-tetrahydropyrimido[4,5-b]quinolin-4-amine.
Chemical Property Profile of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine
Property Insights of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine
The XLogP value of 3.6863 indicates that 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 107.83 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine. Following Lipinski's Rule of Five, 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine has 1 hydrogen bond donor(s) and 7 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 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine?
The CAS number of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine is 673446-27-0.
What is the molecular formula of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine?
The molecular formula of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine is C18H17N5O2S.
What is the molecular weight of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine?
The molecular weight of 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine is 367.11 g/mol.
Where can I buy 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine?
You can request a quote for 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Nitro-benzylsulfanyl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]quinolin-4-ylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.