AF-399/42289968
TL;DR: AF-399/42289968 (CAS 620544-33-4) is a chemical compound with molecular formula C21H19F3N4O and molecular weight 400.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(pyridin-3-ylmethyl)-4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzamide
Also Known As: AF-399/42289968, N-(pyridin-3-ylmethyl)-4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzamide, N-(3-pyridylmethyl){4-[3-(trifluoromethyl)(1H-4,5,6,7-tetrahydroindazolyl)]phe nyl}carboxamide, N-(pyridin-3-ylmethyl)-4-(3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl)benzamide, N-(pyridin-3-ylmethyl)-4-[3-(trifluoromethyl)-4,5,6,7-tetrahydro-1H-indazol-1-yl]benzamide
| Molecular Formula | C21H19F3N4O |
|---|---|
| Molecular Weight | 400.15 g/mol |
| LogP | 4.0949 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 400.1511 |
| Heavy Atoms | 29 |
| Complexity | 1010.90063 |
Chemical Identifiers
| CAS Number | 620544-33-4 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=NN2C3=CC=C(C=C3)C(=O)NCC4=CN=CC=C4)C(F)(F)F |
Product Overview
AF-399/42289968 (CAS 620544-33-4), with molecular formula C21H19F3N4O and molecular weight 400.15 g/mol. IUPAC: N-(pyridin-3-ylmethyl)-4-[3-(trifluoromethyl)-4,5,6,7-tetrahydroindazol-1-yl]benzamide.
Chemical Property Profile of AF-399/42289968
Property Insights of AF-399/42289968
The XLogP value of 4.0949 indicates that AF-399/42289968 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, AF-399/42289968 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, AF-399/42289968 has 1 hydrogen bond donor(s) and 3 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-399/42289968?
The CAS number of AF-399/42289968 is 620544-33-4.
What is the molecular formula of AF-399/42289968?
The molecular formula of AF-399/42289968 is C21H19F3N4O.
What is the molecular weight of AF-399/42289968?
The molecular weight of AF-399/42289968 is 400.15 g/mol.
Where can I buy AF-399/42289968?
You can request a quote for AF-399/42289968 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AF-399/42289968?
Yes, KEHONG BIO provides custom synthesis services for AF-399/42289968 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.