F0648-0015
TL;DR: F0648-0015 (CAS 852046-55-0) is a chemical compound with molecular formula C21H24N6O3S and molecular weight 440.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[[5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
Also Known As: F0648-0015, 6-((5-((2-(4-methylpiperidin-1-yl)-2-oxoethyl)thio)-4-phenyl-4H-1,2,4-triazol-3-yl)methyl)pyrimidine-2,4(1H,3H)-dione, 6-[(5-{[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl}-4-phenyl-4H-1,2,4-triazol-3-yl)methyl]-1,2,3,4-tetrahydropyrimidine-2,4-dione, 6-[[5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione
| Molecular Formula | C21H24N6O3S |
|---|---|
| Molecular Weight | 440.16 g/mol |
| LogP | 1.5853 |
| Topological Polar Surface Area | 116.74 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 440.16306 |
| Heavy Atoms | 31 |
| Complexity | 1133.3534 |
Chemical Identifiers
| CAS Number | 852046-55-0 |
|---|---|
| SMILES | CC1CCN(CC1)C(=O)CSC2=NN=C(N2C3=CC=CC=C3)CC4=CC(=O)NC(=O)N4 |
Product Overview
F0648-0015 (CAS 852046-55-0), with molecular formula C21H24N6O3S and molecular weight 440.16 g/mol. IUPAC: 6-[[5-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-4-phenyl-1,2,4-triazol-3-yl]methyl]-1H-pyrimidine-2,4-dione.
Chemical Property Profile of F0648-0015
Property Insights of F0648-0015
The XLogP value of 1.5853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0648-0015. The TPSA of 116.74 Ų falls within the moderate polarity range, balancing permeability and solubility for F0648-0015. Following Lipinski's Rule of Five, F0648-0015 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 F0648-0015?
The CAS number of F0648-0015 is 852046-55-0.
What is the molecular formula of F0648-0015?
The molecular formula of F0648-0015 is C21H24N6O3S.
What is the molecular weight of F0648-0015?
The molecular weight of F0648-0015 is 440.16 g/mol.
Where can I buy F0648-0015?
You can request a quote for F0648-0015 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0648-0015?
Yes, KEHONG BIO provides custom synthesis services for F0648-0015 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.