3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione
TL;DR: 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione (CAS 37744-82-4) is a chemical compound with molecular formula C14H18N2S and molecular weight 246.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6,6-trimethyl-3-(3-methylphenyl)-1H-pyrimidine-2-thione
Also Known As: USAF K-1341, 2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(m-tolyl)-, 1-(m-Tolyl)-2-thio-4,4,6-trimethyl dihydropyrimidine, 2(1H)-Pyrimidinethione, 3,4-dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-, 4,4,6-trimethyl-1-(3-methylphenyl)-3,4-dihydropyrimidine-2(1h)-thione
| Molecular Formula | C14H18N2S |
|---|---|
| Molecular Weight | 246.12 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 47.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.11906 |
| Heavy Atoms | 17 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 37744-82-4 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C(=CC(NC2=S)(C)C)C |
| InChIKey | POYSSAUIZAGEPU-UHFFFAOYSA-N |
Product Overview
3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione (CAS 37744-82-4), with molecular formula C14H18N2S and molecular weight 246.12 g/mol. IUPAC: 4,6,6-trimethyl-3-(3-methylphenyl)-1H-pyrimidine-2-thione.
Chemical Property Profile of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione
Property Insights of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione
The XLogP value of 3.0 indicates that 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.4 Ų, 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione has 1 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 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione?
The CAS number of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione is 37744-82-4.
What is the molecular formula of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione?
The molecular formula of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione is C14H18N2S.
What is the molecular weight of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione?
The molecular weight of 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione is 246.12 g/mol.
Where can I buy 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione?
You can request a quote for 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-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 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Dihydro-4,4,6-trimethyl-1-(3-methylphenyl)-2(1H)-pyrimidinethione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.