AB01294075-01
TL;DR: AB01294075-01 (CAS 879579-97-2) is a chemical compound with molecular formula C17H16ClN5O and molecular weight 341.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[1-[6-(3-chloroanilino)-2-methylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
Also Known As: AB01294075-01, 1-(1-(6-((3-chlorophenyl)amino)-2-methylpyrimidin-4-yl)-5-methyl-1H-pyrazol-4-yl)ethanone, 1-(1-{6-[(3-chlorophenyl)amino]-2-methylpyrimidin-4-yl}-5-methyl-1H-pyrazol-4-yl)ethanone, 1-[1-[6-(3-chloroanilino)-2-methylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone
| Molecular Formula | C17H16ClN5O |
|---|---|
| Molecular Weight | 341.10 g/mol |
| LogP | 3.87874 |
| Topological Polar Surface Area | 72.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 341.10434 |
| Heavy Atoms | 24 |
| Complexity | 919.0944 |
Chemical Identifiers
| CAS Number | 879579-97-2 |
|---|---|
| SMILES | CC1=C(C=NN1C2=NC(=NC(=C2)NC3=CC(=CC=C3)Cl)C)C(=O)C |
Product Overview
AB01294075-01 (CAS 879579-97-2), with molecular formula C17H16ClN5O and molecular weight 341.10 g/mol. IUPAC: 1-[1-[6-(3-chloroanilino)-2-methylpyrimidin-4-yl]-5-methylpyrazol-4-yl]ethanone.
Chemical Property Profile of AB01294075-01
Property Insights of AB01294075-01
The XLogP value of 3.87874 indicates that AB01294075-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.7 Ų falls within the moderate polarity range, balancing permeability and solubility for AB01294075-01. Following Lipinski's Rule of Five, AB01294075-01 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
Frequently Asked Questions
What is the CAS number of AB01294075-01?
The CAS number of AB01294075-01 is 879579-97-2.
What is the molecular formula of AB01294075-01?
The molecular formula of AB01294075-01 is C17H16ClN5O.
What is the molecular weight of AB01294075-01?
The molecular weight of AB01294075-01 is 341.10 g/mol.
Where can I buy AB01294075-01?
You can request a quote for AB01294075-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB01294075-01?
Yes, KEHONG BIO provides custom synthesis services for AB01294075-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.