F0528-1545
TL;DR: F0528-1545 (CAS 476438-96-7) is a chemical compound with molecular formula C21H34N4OS and molecular weight 390.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide
Also Known As: F0528-1545, (1s,3s)-N-((4-butyl-5-(isopropylthio)-4H-1,2,4-triazol-3-yl)methyl)adamantane-1-carboxamide, N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide, N-{[4-butyl-5-(propan-2-ylsulfanyl)-4H-1,2,4-triazol-3-yl]methyl}adamantane-1-carboxamide
| Molecular Formula | C21H34N4OS |
|---|---|
| Molecular Weight | 390.25 g/mol |
| LogP | 4.4113 |
| Topological Polar Surface Area | 59.81 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 390.24533 |
| Heavy Atoms | 27 |
| Complexity | 648.4373 |
Chemical Identifiers
| CAS Number | 476438-96-7 |
|---|---|
| SMILES | CCCCN1C(=NN=C1SC(C)C)CNC(=O)C23CC4CC(C2)CC(C4)C3 |
Product Overview
F0528-1545 (CAS 476438-96-7), with molecular formula C21H34N4OS and molecular weight 390.25 g/mol. IUPAC: N-[(4-butyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)methyl]adamantane-1-carboxamide.
Chemical Property Profile of F0528-1545
Property Insights of F0528-1545
The XLogP value of 4.4113 indicates that F0528-1545 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.81 Ų, F0528-1545 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0528-1545 has 1 hydrogen bond donor(s) and 4 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 F0528-1545?
The CAS number of F0528-1545 is 476438-96-7.
What is the molecular formula of F0528-1545?
The molecular formula of F0528-1545 is C21H34N4OS.
What is the molecular weight of F0528-1545?
The molecular weight of F0528-1545 is 390.25 g/mol.
Where can I buy F0528-1545?
You can request a quote for F0528-1545 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0528-1545?
Yes, KEHONG BIO provides custom synthesis services for F0528-1545 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.