F0591-1168
TL;DR: F0591-1168 (CAS 687579-14-2) is a chemical compound with molecular formula C25H25FN4OS and molecular weight 448.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(2-methoxyphenyl)-1-(pyridin-4-ylmethyl)thiourea
Also Known As: F0591-1168, 1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(2-methoxyphenyl)-1-(pyridin-4-ylmethyl)thiourea, 1-(2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl)-3-(2-methoxyphenyl)-1-(pyridin-4-ylmethyl)thiourea, 1-[2-(5-FLUORO-2-METHYL-1H-INDOL-3-YL)ETHYL]-3-(2-METHOXYPHENYL)-1-[(PYRIDIN-4-YL)METHYL]THIOUREA
| Molecular Formula | C25H25FN4OS |
|---|---|
| Molecular Weight | 448.17 g/mol |
| LogP | 5.46072 |
| Topological Polar Surface Area | 53.18 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 448.1733 |
| Heavy Atoms | 32 |
| Complexity | 1225.3342 |
Chemical Identifiers
| CAS Number | 687579-14-2 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)F)CCN(CC3=CC=NC=C3)C(=S)NC4=CC=CC=C4OC |
Product Overview
F0591-1168 (CAS 687579-14-2), with molecular formula C25H25FN4OS and molecular weight 448.17 g/mol. IUPAC: 1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-(2-methoxyphenyl)-1-(pyridin-4-ylmethyl)thiourea.
Chemical Property Profile of F0591-1168
Property Insights of F0591-1168
The XLogP value of 5.46072 indicates that F0591-1168 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.18 Ų, F0591-1168 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, F0591-1168 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0591-1168?
The CAS number of F0591-1168 is 687579-14-2.
What is the molecular formula of F0591-1168?
The molecular formula of F0591-1168 is C25H25FN4OS.
What is the molecular weight of F0591-1168?
The molecular weight of F0591-1168 is 448.17 g/mol.
Where can I buy F0591-1168?
You can request a quote for F0591-1168 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0591-1168?
Yes, KEHONG BIO provides custom synthesis services for F0591-1168 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.