AB00667591-01
TL;DR: AB00667591-01 (CAS 301679-32-3) is a chemical compound with molecular formula C14H13N5O3 and molecular weight 299.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide
Also Known As: AB00667591-01, (E)-2-(3,5-dioxo-2,3,4,5-tetrahydro-1,2,4-triazin-6-yl)-N'-((E)-3-phenylallylidene)acetohydrazide, 2-(3,5-dihydroxy-1,2,4-triazin-6-yl)-N'-[(1E,2E)-3-phenylprop-2-en-1-ylidene]acetohydrazide, 2-(3,5-dihydroxy-1,2,4-triazin-6-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide, 2-(3,5-DIOXO-2,3,4,5-TETRAHYDRO-1,2,4-TRIAZIN-6-YL)-N'-[(1E,2E)-3-PHENYLPROP-2-EN-1-YLIDENE]ACETOHYDRAZIDE
| Molecular Formula | C14H13N5O3 |
|---|---|
| Molecular Weight | 299.10 g/mol |
| LogP | -0.1839 |
| Topological Polar Surface Area | 120.07 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 299.10184 |
| Heavy Atoms | 22 |
| Complexity | 804.9732 |
Chemical Identifiers
| CAS Number | 301679-32-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)/C=C/C=N/NC(=O)CC2=NNC(=O)NC2=O |
Product Overview
AB00667591-01 (CAS 301679-32-3), with molecular formula C14H13N5O3 and molecular weight 299.10 g/mol. IUPAC: 2-(3,5-dioxo-2H-1,2,4-triazin-6-yl)-N-[(E)-[(E)-3-phenylprop-2-enylidene]amino]acetamide.
Chemical Property Profile of AB00667591-01
Property Insights of AB00667591-01
The XLogP value of -0.1839 indicates that AB00667591-01 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 120.07 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00667591-01. Following Lipinski's Rule of Five, AB00667591-01 has 3 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 AB00667591-01?
The CAS number of AB00667591-01 is 301679-32-3.
What is the molecular formula of AB00667591-01?
The molecular formula of AB00667591-01 is C14H13N5O3.
What is the molecular weight of AB00667591-01?
The molecular weight of AB00667591-01 is 299.10 g/mol.
Where can I buy AB00667591-01?
You can request a quote for AB00667591-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00667591-01?
Yes, KEHONG BIO provides custom synthesis services for AB00667591-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.