1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione
TL;DR: 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione (CAS 221287-93-0) is a chemical compound with molecular formula C15H19ClN2S and molecular weight 294.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloro-6-methylphenyl)-3-cyclobutyl-1,3-diazinane-2-thione
Also Known As: 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione, 1-(2-chloro-6-methyl-phenyl)-3-cyclobutyl-1,3-diazinane-2-thione, 1-(2-chloro-6-methylphenyl)-3-cyclobutyl-1,3-diazinane-2-thione, 1-(6-Chloro-2-methyl-phenyl)-3-cyclobutyl-3,4,5,6-tetrahydropyrimidine-2(1H)-thione
| Molecular Formula | C15H19ClN2S |
|---|---|
| Molecular Weight | 294.10 g/mol |
| LogP | 3.99792 |
| Topological Polar Surface Area | 6.48 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 294.09573 |
| Heavy Atoms | 19 |
| Complexity | 478.66898 |
Chemical Identifiers
| CAS Number | 221287-93-0 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)Cl)N2CCCN(C2=S)C3CCC3 |
Product Overview
1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione (CAS 221287-93-0), with molecular formula C15H19ClN2S and molecular weight 294.10 g/mol. IUPAC: 1-(2-chloro-6-methylphenyl)-3-cyclobutyl-1,3-diazinane-2-thione.
Chemical Property Profile of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione
Property Insights of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione
The XLogP value of 3.99792 indicates that 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.48 Ų, 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione has 0 hydrogen bond donor(s) and 1 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 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione?
The CAS number of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione is 221287-93-0.
What is the molecular formula of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione?
The molecular formula of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione is C15H19ClN2S.
What is the molecular weight of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione?
The molecular weight of 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione is 294.10 g/mol.
Where can I buy 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione?
You can request a quote for 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Chloro-6-methylphenyl)-3-cyclobutyltetrahydro-2(1H)-pyrimidinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.