4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-
TL;DR: 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- (CAS 57737-63-0) is a chemical compound with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione
Also Known As: 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-, 1-((3,4-Dimethoxyphenyl)methyl)dihydro-2-thioxo-4,6(1H,5H)-pyrimidinedione, 1-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione, 4,6(1H,5H)-Pyrimidinedione, 1-[(3,4-dimethoxyphenyl)methyl]dihydro-2-thioxo-
| Molecular Formula | C13H14N2O4S |
|---|---|
| Molecular Weight | 294.07 g/mol |
| LogP | 0.8372 |
| Topological Polar Surface Area | 67.87 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.0674 |
| Heavy Atoms | 20 |
| Complexity | 553.4896 |
Chemical Identifiers
| CAS Number | 57737-63-0 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CN2C(=O)CC(=O)NC2=S)OC |
Product Overview
4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- (CAS 57737-63-0), with molecular formula C13H14N2O4S and molecular weight 294.07 g/mol. IUPAC: 1-[(3,4-dimethoxyphenyl)methyl]-2-sulfanylidene-1,3-diazinane-4,6-dione.
Chemical Property Profile of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-
Property Insights of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-
The XLogP value of 0.8372 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-. The TPSA of 67.87 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-. Following Lipinski's Rule of Five, 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- has 1 hydrogen bond donor(s) and 5 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 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-?
The CAS number of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- is 57737-63-0.
What is the molecular formula of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-?
The molecular formula of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- is C13H14N2O4S.
What is the molecular weight of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-?
The molecular weight of 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- is 294.07 g/mol.
Where can I buy 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-?
You can request a quote for 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo-?
Yes, KEHONG BIO provides custom synthesis services for 4,6(1H,5H)-Pyrimidinedione, 1-((3,4-dimethoxyphenyl)methyl)dihydro-2-thioxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.