![[(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py structure](/static/products/313/31349-32-3.png)
[(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py
TL;DR: [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py (CAS 31349-32-3) is a chemical compound with molecular formula C19H17N5OS2 and molecular weight 395.09 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-pyrimidin-6-yl]methylideneamino]thiourea
Also Known As: [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py|[[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]thiourea
| Molecular Formula | C19H17N5OS2 |
|---|---|
| Molecular Weight | 395.09 g/mol |
| LogP | 2.85739 |
| Topological Polar Surface Area | 99.06 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.08746 |
| Heavy Atoms | 27 |
| Complexity | 1085.578 |
Chemical Identifiers
| CAS Number | 31349-32-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC3=C(NC(=S)NC3=O)C=NNC(=S)N |
Product Overview
[(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py (CAS 31349-32-3), with molecular formula C19H17N5OS2 and molecular weight 395.09 g/mol. IUPAC: [[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-pyrimidin-6-yl]methylideneamino]thiourea.
Chemical Property Profile of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py
Property Insights of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py
The XLogP value of 2.85739 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py. The TPSA of 99.06 Ų falls within the moderate polarity range, balancing permeability and solubility for [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py. Following Lipinski's Rule of Five, [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py has 4 hydrogen bond donor(s) and 4 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 [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py?
The CAS number of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py is 31349-32-3.
What is the molecular formula of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py?
The molecular formula of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py is C19H17N5OS2.
What is the molecular weight of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py?
The molecular weight of [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py is 395.09 g/mol.
Where can I buy [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py?
You can request a quote for [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py?
Yes, KEHONG BIO provides custom synthesis services for [(E)-[4-oxo-5-[(4-phenylphenyl)methyl]-2-sulfanylidene-1H-py and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.