F0648-0103
TL;DR: F0648-0103 (CAS 852047-21-3) is a chemical compound with molecular formula C19H16N6O2S and molecular weight 392.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[4-phenyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
Also Known As: F0648-0103, 6-((4-phenyl-5-((pyridin-3-ylmethyl)thio)-4H-1,2,4-triazol-3-yl)methyl)pyrimidine-2,4(1H,3H)-dione, 6-[(4-phenyl-5-{[(pyridin-3-yl)methyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione, 6-[[4-phenyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
| Molecular Formula | C19H16N6O2S |
|---|---|
| Molecular Weight | 392.11 g/mol |
| LogP | 1.922 |
| Topological Polar Surface Area | 109.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 392.10553 |
| Heavy Atoms | 28 |
| Complexity | 1156.0319 |
Chemical Identifiers
| CAS Number | 852047-21-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)N2C(=NN=C2SCC3=CN=CC=C3)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0103 (CAS 852047-21-3), with molecular formula C19H16N6O2S and molecular weight 392.11 g/mol. IUPAC: 6-[[4-phenyl-5-(pyridin-3-ylmethylsulfanyl)-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of F0648-0103
Property Insights of F0648-0103
The XLogP value of 1.922 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0103. The TPSA of 109.32 Ų falls within the moderate polarity range, balancing permeability and solubility for F0648-0103. Following Lipinski's Rule of Five, F0648-0103 has 2 hydrogen bond donor(s) and 6 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 F0648-0103?
The CAS number of F0648-0103 is 852047-21-3.
What is the molecular formula of F0648-0103?
The molecular formula of F0648-0103 is C19H16N6O2S.
What is the molecular weight of F0648-0103?
The molecular weight of F0648-0103 is 392.11 g/mol.
Where can I buy F0648-0103?
You can request a quote for F0648-0103 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0103?
Yes, KEHONG BIO provides custom synthesis services for F0648-0103 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.