F3412-0040
TL;DR: F3412-0040 (CAS 1005694-04-1) is a chemical compound with molecular formula C13H16N6O and molecular weight 272.13855 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[7-(1,3-dimethylpyrazol-4-yl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone
Also Known As: F3412-0040, 1-(7-(1,3-dimethyl-1H-pyrazol-4-yl)-5-methyl-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)ethanone, 1-[7-(1,3-dimethylpyrazol-4-yl)-5-methyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl]ethanone, 1-[6-methyl-4-(1-methyl-3-methyl-4-pyrazolyl)-1,3,3a,7-tetraaza-4,7-dihydro-5-indenyl]-1-ethanone, 1-[7-(1,3-DIMETHYL-1H-PYRAZOL-4-YL)-5-METHYL-4,7-DIHYDRO[1,2,4]TRIAZOLO[1,5-A]PYRIMIDIN-6-YL]-1-ETHANONE
Technical Specifications
| Molecular Formula | C13H16N6O |
| Molecular Weight | 272.13855 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 77.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 272.13855 Da |
| Heavy Atoms | 20 |
| Complexity | 450.0 |
| SMILES | CC1=C(C(N2C(=NC=N2)N1)C3=CN(N=C3C)C)C(=O)C |
| InChIKey | UYCQCWRSDDFOGO-UHFFFAOYSA-N |
Chemical Property Profile of F3412-0040
Property Insights of F3412-0040
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F3412-0040. The TPSA of 77.6 Ų falls within the moderate polarity range, balancing permeability and solubility for F3412-0040. Following Lipinski's Rule of Five, F3412-0040 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of F3412-0040?
The CAS number of F3412-0040 is 1005694-04-1.
What is the molecular formula of F3412-0040?
The molecular formula of F3412-0040 is C13H16N6O.
What is the molecular weight of F3412-0040?
The molecular weight of F3412-0040 is 272.13855 g/mol.
Where can I buy F3412-0040?
You can request a quote for F3412-0040 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for F3412-0040?
Yes, CoreyChem provides custom synthesis services for F3412-0040 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.