![4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde structure](/static/products/2874/28747-52-6.webp)
4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
TL;DR: 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde (CAS 28747-52-6) is a chemical compound with molecular formula C18H14N2O2S and molecular weight 322.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
Also Known As: 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidi, 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde, 5-[([1,1'-Biphenyl]-4-yl)methyl]-6-oxo-2-sulfanylidene-1,2,3,6-tetrahydropyrimidine-4-carbaldehyde
| Molecular Formula | C18H14N2O2S |
|---|---|
| Molecular Weight | 322.08 g/mol |
| LogP | 3.50279 |
| Topological Polar Surface Area | 65.72 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 322.0776 |
| Heavy Atoms | 23 |
| Complexity | 941.25073 |
Chemical Identifiers
| CAS Number | 28747-52-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NC(=S)NC3=O)C=O |
Product Overview
4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde (CAS 28747-52-6), with molecular formula C18H14N2O2S and molecular weight 322.08 g/mol. IUPAC: 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde.
Chemical Property Profile of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
Property Insights of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde
The XLogP value of 3.50279 indicates that 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.72 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde. Following Lipinski's Rule of Five, 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde 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
Frequently Asked Questions
What is the CAS number of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde?
The CAS number of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde is 28747-52-6.
What is the molecular formula of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde?
The molecular formula of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde is C18H14N2O2S.
What is the molecular weight of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde?
The molecular weight of 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde is 322.08 g/mol.
Where can I buy 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde?
You can request a quote for 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde?
Yes, KEHONG BIO provides custom synthesis services for 4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidine-6-carbaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.