AF-399/43343330
TL;DR: AF-399/43343330 (CAS 879448-63-2) is a chemical compound with molecular formula C14H12ClN5O2S and molecular weight 349.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(5-chloro-2-hydroxyphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide
Also Known As: AF-399/43343330, 3-(5-chloro-2-hydroxyphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide, 5-(5-chloro-2-hydroxyphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-3-carboxamide, (5Z)-5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1,2-dihydropyrazole-3-carboxamide, 5-(3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1,2-dihydropyrazole-3-carboxamide
| Molecular Formula | C14H12ClN5O2S |
|---|---|
| Molecular Weight | 349.04 g/mol |
| LogP | 3.1019 |
| Topological Polar Surface Area | 103.79 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 349.04 |
| Heavy Atoms | 23 |
| Complexity | 860.4821 |
Chemical Identifiers
| CAS Number | 879448-63-2 |
|---|---|
| SMILES | CCC1=NN=C(S1)NC(=O)C2=CC(=NN2)C3=C(C=CC(=C3)Cl)O |
Product Overview
AF-399/43343330 (CAS 879448-63-2), with molecular formula C14H12ClN5O2S and molecular weight 349.04 g/mol. IUPAC: 3-(5-chloro-2-hydroxyphenyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-1H-pyrazole-5-carboxamide.
Chemical Property Profile of AF-399/43343330
Property Insights of AF-399/43343330
The XLogP value of 3.1019 indicates that AF-399/43343330 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 103.79 Ų falls within the moderate polarity range, balancing permeability and solubility for AF-399/43343330. Following Lipinski's Rule of Five, AF-399/43343330 has 3 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 AF-399/43343330?
The CAS number of AF-399/43343330 is 879448-63-2.
What is the molecular formula of AF-399/43343330?
The molecular formula of AF-399/43343330 is C14H12ClN5O2S.
What is the molecular weight of AF-399/43343330?
The molecular weight of AF-399/43343330 is 349.04 g/mol.
Where can I buy AF-399/43343330?
You can request a quote for AF-399/43343330 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/43343330?
Yes, KEHONG BIO provides custom synthesis services for AF-399/43343330 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.