1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-
TL;DR: 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- (CAS 1194-71-4) is a chemical compound with molecular formula CN1C=CC(=O)N(C1=S)C and molecular weight 156.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-2-sulfanylidenepyrimidin-4-one
Also Known As: 1,3-Dimethyl-2-thiouracil, 1-Methyl-3-methyl-2-thiouracil, 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-, 1,3-dimethyl-2-sulfanylidenepyrimidin-4-one, 1,2-Dihydro-1,3-dimethyl-2-thioxopyrimidin-4(3H)-one
| Molecular Formula | CN1C=CC(=O)N(C1=S)C |
|---|---|
| Molecular Weight | 156.04 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 55.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 156.03574 |
| Heavy Atoms | 10 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 1194-71-4 |
|---|---|
| SMILES | CN1C=CC(=O)N(C1=S)C |
| InChIKey | KKGQZFFYBBQLKI-UHFFFAOYSA-N |
Product Overview
1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- (CAS 1194-71-4), with molecular formula CN1C=CC(=O)N(C1=S)C and molecular weight 156.04 g/mol. IUPAC: 1,3-dimethyl-2-sulfanylidenepyrimidin-4-one.
Chemical Property Profile of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-
Property Insights of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-. With a topological polar surface area (TPSA) of 55.6 Ų, 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- has 0 hydrogen bond donor(s) and 2 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 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-?
The CAS number of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- is 1194-71-4.
What is the molecular formula of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-?
The molecular formula of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- is CN1C=CC(=O)N(C1=S)C.
What is the molecular weight of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-?
The molecular weight of 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- is 156.04 g/mol.
Where can I buy 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-?
You can request a quote for 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl-?
Yes, KEHONG BIO provides custom synthesis services for 1H,3H-Pyrimidine-4-one-2-thione, 1,3-dimethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.