phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5
TL;DR: phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 (CAS 1674-52-8) is a chemical compound with molecular formula C21H22N4O2S and molecular weight 394.14636 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5-yl)propyl]-N-phenylcarbamate
Also Known As: phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5, phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5-yl)propyl]-N-phenylcarbamate, Phenyl [3-(2-amino-6-methyl-4-sulfanylidene-1,4-dihydropyrimidin-5-yl)propyl](phenyl)carbamate
Technical Specifications
| Molecular Formula | C21H22N4O2S |
| Molecular Weight | 394.14636 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 112.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 394.14636 Da |
| Heavy Atoms | 28 |
| Complexity | 634.0 |
| SMILES | CC1=C(C(=S)N=C(N1)N)CCCN(C2=CC=CC=C2)C(=O)OC3=CC=CC=C3 |
| InChIKey | PMSHAQAQBNHNNM-UHFFFAOYSA-N |
Chemical Property Profile of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5
Property Insights of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5
The XLogP value of 3.3 indicates that phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 112.0 Ų falls within the moderate polarity range, balancing permeability and solubility for phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5. Following Lipinski's Rule of Five, phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5?
The CAS number of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 is 1674-52-8.
What is the molecular formula of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5?
The molecular formula of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 is C21H22N4O2S.
What is the molecular weight of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5?
The molecular weight of phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 is 394.14636 g/mol.
Where can I buy phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5?
You can request a quote for phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5?
Yes, CoreyChem provides custom synthesis services for phenyl N-[3-(2-amino-6-methyl-4-sulfanylidene-1H-pyrimidin-5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.