6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione
TL;DR: 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione (CAS 301330-88-1) is a chemical compound with molecular formula C12H12N4O4S and molecular weight 308.05792 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione
Also Known As: 6-amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione, 6-Amino-1,3-dimethyl-5-[(2-nitrophenyl)sulfanyl]pyrimidine-2,4(1H,3H)-dione
Technical Specifications
| Molecular Formula | C12H12N4O4S |
| Molecular Weight | 308.05792 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 138.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 308.05792 Da |
| Heavy Atoms | 21 |
| Complexity | 516.0 |
| SMILES | CN1C(=C(C(=O)N(C1=O)C)SC2=CC=CC=C2[N+](=O)[O-])N |
| InChIKey | ZEJYKDWVCSMFKK-UHFFFAOYSA-N |
Chemical Property Profile of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione
Property Insights of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione. The TPSA of 138.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione. Following Lipinski's Rule of Five, 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione?
The CAS number of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione is 301330-88-1.
What is the molecular formula of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione?
The molecular formula of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione is C12H12N4O4S.
What is the molecular weight of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione?
The molecular weight of 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione is 308.05792 g/mol.
Where can I buy 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione?
You can request a quote for 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione?
Yes, CoreyChem provides custom synthesis services for 6-Amino-1,3-dimethyl-5-(2-nitrophenyl)sulfanylpyrimidine-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.