A2323/0097964
TL;DR: A2323/0097964 (CAS 372508-63-9) is a chemical compound with molecular formula C18H20F6N2O6S and molecular weight 506.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: A2323/0097964, methyl 2-({[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]carbamoyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 3,3,3-trifluoro-2-({N-[3-(methoxycarbonyl)(4,5,6,7-tetrahydrobenzo[b]thi ophen-2-yl)]carbamoyl}amino)-2-(2,2,2-trifluoroethoxy)propanoate, methyl 2-(3-(3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl)ureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-[[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
| Molecular Formula | C18H20F6N2O6S |
|---|---|
| Molecular Weight | 506.09 g/mol |
| LogP | 3.9356 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 506.09464 |
| Heavy Atoms | 33 |
| Complexity | 900.2119 |
Chemical Identifiers
| CAS Number | 372508-63-9 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OC)OCC(F)(F)F |
Product Overview
A2323/0097964 (CAS 372508-63-9), with molecular formula C18H20F6N2O6S and molecular weight 506.09 g/mol. IUPAC: methyl 2-[[3-ethoxy-1,1,1-trifluoro-3-oxo-2-(2,2,2-trifluoroethoxy)propan-2-yl]carbamoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of A2323/0097964
Property Insights of A2323/0097964
The XLogP value of 3.9356 indicates that A2323/0097964 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.96 Ų falls within the moderate polarity range, balancing permeability and solubility for A2323/0097964. Following Lipinski's Rule of Five, A2323/0097964 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2323/0097964?
The CAS number of A2323/0097964 is 372508-63-9.
What is the molecular formula of A2323/0097964?
The molecular formula of A2323/0097964 is C18H20F6N2O6S.
What is the molecular weight of A2323/0097964?
The molecular weight of A2323/0097964 is 506.09 g/mol.
Where can I buy A2323/0097964?
You can request a quote for A2323/0097964 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2323/0097964?
Yes, KEHONG BIO provides custom synthesis services for A2323/0097964 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.