AB00676610-01
TL;DR: AB00676610-01 (CAS 872590-58-4) is a chemical compound with molecular formula C17H13FN6O3 and molecular weight 368.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-fluorophenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(furan-2-ylmethyl)acetamide
Also Known As: AB00676610-01, F1876-0067, 2-[3-(3-fluorophenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(furan-2-ylmethyl)acetamide, 2-(3-(3-fluorophenyl)-7-oxo-3H-[1,2,3]triazolo[4,5-d]pyrimidin-6(7H)-yl)-N-(furan-2-ylmethyl)acetamide, 2-[3-(3-fluorophenyl)-7-oxo-3H,6H,7H-[1,2,3]triazolo[4,5-d]pyrimidin-6-yl]-N-[(furan-2-yl)methyl]acetamide
| Molecular Formula | C17H13FN6O3 |
|---|---|
| Molecular Weight | 368.10 g/mol |
| LogP | 1.0257 |
| Topological Polar Surface Area | 107.84 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1033 |
| Heavy Atoms | 27 |
| Complexity | 1165.102 |
Chemical Identifiers
| CAS Number | 872590-58-4 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)N2C3=C(C(=O)N(C=N3)CC(=O)NCC4=CC=CO4)N=N2 |
Product Overview
AB00676610-01 (CAS 872590-58-4), with molecular formula C17H13FN6O3 and molecular weight 368.10 g/mol. IUPAC: 2-[3-(3-fluorophenyl)-7-oxotriazolo[4,5-d]pyrimidin-6-yl]-N-(furan-2-ylmethyl)acetamide.
Chemical Property Profile of AB00676610-01
Property Insights of AB00676610-01
The XLogP value of 1.0257 suggests moderate lipophilicity, balancing water solubility and membrane permeability for AB00676610-01. The TPSA of 107.84 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00676610-01. Following Lipinski's Rule of Five, AB00676610-01 has 1 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 AB00676610-01?
The CAS number of AB00676610-01 is 872590-58-4.
What is the molecular formula of AB00676610-01?
The molecular formula of AB00676610-01 is C17H13FN6O3.
What is the molecular weight of AB00676610-01?
The molecular weight of AB00676610-01 is 368.10 g/mol.
Where can I buy AB00676610-01?
You can request a quote for AB00676610-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00676610-01?
Yes, KEHONG BIO provides custom synthesis services for AB00676610-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.