ASN 06196368
TL;DR: ASN 06196368 (CAS 957500-73-1) is a chemical compound with molecular formula C21H24F3N3OS and molecular weight 423.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]-3-[4-(trifluoromethyl)phenyl]urea
Also Known As: ASN 06196368, N-[9-(2-Thienylmethyl)-9-azabicyclo[3.3.1]non-3-yl]-N'-[4-(trifluoromethyl)phenyl]urea, 1-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]-3-[4-(trifluoromethyl)phenyl]urea, N-[9-(2-Thienylmethyl)-9-azabicyclo[3.3.1]non-3-yl]-Na(2)-[4-(trifluoromethyl)phenyl]urea, N-{9-[(Thiophen-2-yl)methyl]-9-azabicyclo[3.3.1]nonan-3-yl}-N'-[4-(trifluoromethyl)phenyl]urea
| Molecular Formula | C21H24F3N3OS |
|---|---|
| Molecular Weight | 423.16 g/mol |
| LogP | 5.4741 |
| Topological Polar Surface Area | 44.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 423.1592 |
| Heavy Atoms | 29 |
| Complexity | 808.6969 |
Chemical Identifiers
| CAS Number | 957500-73-1 |
|---|---|
| SMILES | C1CC2CC(CC(C1)N2CC3=CC=CS3)NC(=O)NC4=CC=C(C=C4)C(F)(F)F |
Product Overview
ASN 06196368 (CAS 957500-73-1), with molecular formula C21H24F3N3OS and molecular weight 423.16 g/mol. IUPAC: 1-[9-(thiophen-2-ylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl]-3-[4-(trifluoromethyl)phenyl]urea.
Chemical Property Profile of ASN 06196368
Property Insights of ASN 06196368
The XLogP value of 5.4741 indicates that ASN 06196368 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.37 Ų, ASN 06196368 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ASN 06196368 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 ASN 06196368?
The CAS number of ASN 06196368 is 957500-73-1.
What is the molecular formula of ASN 06196368?
The molecular formula of ASN 06196368 is C21H24F3N3OS.
What is the molecular weight of ASN 06196368?
The molecular weight of ASN 06196368 is 423.16 g/mol.
Where can I buy ASN 06196368?
You can request a quote for ASN 06196368 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06196368?
Yes, KEHONG BIO provides custom synthesis services for ASN 06196368 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.