AB00587082-02
TL;DR: AB00587082-02 (CAS 872591-04-3) is a chemical compound with molecular formula C17H15N7O3 and molecular weight 365.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylphenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]acetamide
Also Known As: AB00587082-02, F1876-0622, N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylphenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]acetamide, N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylphenyl)-7-oxo-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]acetamide, N-(5-methylisoxazol-3-yl)-2-(7-oxo-3-(m-tolyl)-3H-[1,2,3]triazolo[4,5-d]pyrimidin-6(7H)-yl)acetamide
| Molecular Formula | C17H15N7O3 |
|---|---|
| Molecular Weight | 365.12 g/mol |
| LogP | 1.22074 |
| Topological Polar Surface Area | 120.73 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.12363 |
| Heavy Atoms | 27 |
| Complexity | 1204.6868 |
Chemical Identifiers
| CAS Number | 872591-04-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)N2C3=C(C(=O)N(C=N3)CC(=O)NC4=NOC(=C4)C)N=N2 |
Product Overview
AB00587082-02 (CAS 872591-04-3), with molecular formula C17H15N7O3 and molecular weight 365.12 g/mol. IUPAC: N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(3-methylphenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]acetamide.
Chemical Property Profile of AB00587082-02
Property Insights of AB00587082-02
The XLogP value of 1.22074 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00587082-02. The TPSA of 120.73 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00587082-02. Following Lipinski's Rule of Five, AB00587082-02 has 1 hydrogen bond donor(s) and 7 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 AB00587082-02?
The CAS number of AB00587082-02 is 872591-04-3.
What is the molecular formula of AB00587082-02?
The molecular formula of AB00587082-02 is C17H15N7O3.
What is the molecular weight of AB00587082-02?
The molecular weight of AB00587082-02 is 365.12 g/mol.
Where can I buy AB00587082-02?
You can request a quote for AB00587082-02 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00587082-02?
Yes, KEHONG BIO provides custom synthesis services for AB00587082-02 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.