AF-399/14339007
TL;DR: AF-399/14339007 (CAS 402511-98-2) is a chemical compound with molecular formula C17H13N5O2S and molecular weight 351.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-hydroxy-1H-indol-3-yl)imino]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide
Also Known As: AF-399/14339007, (Z)-3-(5-methylthiophen-2-yl)-N'-(2-oxoindolin-3-ylidene)-1H-pyrazole-5-carbohydrazide, 5-(5-methylthiophen-2-yl)-N'-(2-oxoindol-3-yl)-1H-pyrazole-3-carbohydrazide, 3-(5-methyl-2-thienyl)-N'-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-1H-pyrazole-5-carbohydrazide, 3-(5-methyl-2-thienyl)-N'-[(3Z)-2-oxo-1,2-dihydro-3H-indol-3-ylidene]-1H-pyrazole-5-carbohydrazide
| Molecular Formula | C17H13N5O2S |
|---|---|
| Molecular Weight | 351.08 g/mol |
| LogP | 4.55762 |
| Topological Polar Surface Area | 106.49 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 351.079 |
| Heavy Atoms | 25 |
| Complexity | 1105.3518 |
Chemical Identifiers
| CAS Number | 402511-98-2 |
|---|---|
| SMILES | CC1=CC=C(S1)C2=CC(=NN2)C(=O)N=NC3=C(NC4=CC=CC=C43)O |
Product Overview
AF-399/14339007 (CAS 402511-98-2), with molecular formula C17H13N5O2S and molecular weight 351.08 g/mol. IUPAC: N-[(2-hydroxy-1H-indol-3-yl)imino]-5-(5-methylthiophen-2-yl)-1H-pyrazole-3-carboxamide.
Chemical Property Profile of AF-399/14339007
Property Insights of AF-399/14339007
The XLogP value of 4.55762 indicates that AF-399/14339007 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.49 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/14339007. Following Lipinski's Rule of Five, AF-399/14339007 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 AF-399/14339007?
The CAS number of AF-399/14339007 is 402511-98-2.
What is the molecular formula of AF-399/14339007?
The molecular formula of AF-399/14339007 is C17H13N5O2S.
What is the molecular weight of AF-399/14339007?
The molecular weight of AF-399/14339007 is 351.08 g/mol.
Where can I buy AF-399/14339007?
You can request a quote for AF-399/14339007 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/14339007?
Yes, KEHONG BIO provides custom synthesis services for AF-399/14339007 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.