ChemDiv3_009442
TL;DR: ChemDiv3_009442 (CAS 851970-60-0) is a chemical compound with molecular formula C23H28FN3OS and molecular weight 413.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-cyclohexyl-1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-(furan-2-ylmethyl)thiourea
Also Known As: ChemDiv3_009442, IDI1_027352, 1-cyclohexyl-3-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-3-[(furan-2-yl)methyl]thiourea, 3-cyclohexyl-1-(2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl)-1-(furan-2-ylmethyl)thiourea, BRD-K09033106-001-01-8
| Molecular Formula | C23H28FN3OS |
|---|---|
| Molecular Weight | 413.19 g/mol |
| LogP | 5.46032 |
| Topological Polar Surface Area | 44.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 413.19373 |
| Heavy Atoms | 29 |
| Complexity | 960.07697 |
Chemical Identifiers
| CAS Number | 851970-60-0 |
|---|---|
| SMILES | CC1=C(C2=C(N1)C=CC(=C2)F)CCN(CC3=CC=CO3)C(=S)NC4CCCCC4 |
Product Overview
ChemDiv3_009442 (CAS 851970-60-0), with molecular formula C23H28FN3OS and molecular weight 413.19 g/mol. IUPAC: 3-cyclohexyl-1-[2-(5-fluoro-2-methyl-1H-indol-3-yl)ethyl]-1-(furan-2-ylmethyl)thiourea.
Chemical Property Profile of ChemDiv3_009442
Property Insights of ChemDiv3_009442
The XLogP value of 5.46032 indicates that ChemDiv3_009442 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.2 Ų, ChemDiv3_009442 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv3_009442 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv3_009442?
The CAS number of ChemDiv3_009442 is 851970-60-0.
What is the molecular formula of ChemDiv3_009442?
The molecular formula of ChemDiv3_009442 is C23H28FN3OS.
What is the molecular weight of ChemDiv3_009442?
The molecular weight of ChemDiv3_009442 is 413.19 g/mol.
Where can I buy ChemDiv3_009442?
You can request a quote for ChemDiv3_009442 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv3_009442?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv3_009442 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.