2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione
TL;DR: 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione (CAS 91192-99-3) is a chemical compound with molecular formula C11H11ClN4S and molecular weight 266.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione
Also Known As: 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione, 2-amino-6-(3-chloro-4-methyl-anilino)pyrimidine-4-thiol, 2-amino-6-(3-chloro-4-methyl-anilino)-3H-pyrimidine-4-thione, 2-Amino-6-(3-chloro-4-methylanilino)pyrimidine-4(1H)-thione, 2-Amino-6-[(3-chloro-4-methylphenyl)amino]pyrimidine-4-thiol
| Molecular Formula | C11H11ClN4S |
|---|---|
| Molecular Weight | 266.04 g/mol |
| LogP | 3.42681 |
| Topological Polar Surface Area | 66.73 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 266.0393 |
| Heavy Atoms | 17 |
| Complexity | 608.6607 |
Chemical Identifiers
| CAS Number | 91192-99-3 |
|---|---|
| SMILES | CC1=C(C=C(C=C1)NC2=CC(=S)N=C(N2)N)Cl |
Product Overview
2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione (CAS 91192-99-3), with molecular formula C11H11ClN4S and molecular weight 266.04 g/mol. IUPAC: 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione.
Chemical Property Profile of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione
Property Insights of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione
The XLogP value of 3.42681 indicates that 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.73 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione. Following Lipinski's Rule of Five, 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione has 3 hydrogen bond donor(s) and 4 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-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione?
The CAS number of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione is 91192-99-3.
What is the molecular formula of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione?
The molecular formula of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione is C11H11ClN4S.
What is the molecular weight of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione?
The molecular weight of 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione is 266.04 g/mol.
Where can I buy 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione?
You can request a quote for 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-6-(3-chloro-4-methylanilino)-1H-pyrimidine-4-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.