A2146/0090125
TL;DR: A2146/0090125 (CAS 298683-67-7) is a chemical compound with molecular formula C23H25F3N2O6S and molecular weight 514.14 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-2-[(4-methoxybenzoyl)amino]-3-oxopropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: A2146/0090125, methyl 2-((3-ethoxy-1,1,1-trifluoro-2-(4-methoxybenzamido)-3-oxopropan-2-yl)amino)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, methyl 2-[[3-ethoxy-1,1,1-trifluoro-2-[(4-methoxybenzoyl)amino]-3-oxopropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, methyl 2-({1-(ethoxycarbonyl)-2,2,2-trifluoro-1-[(4-methoxybenzoyl)amino]ethyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, METHYL 2-({3-ETHOXY-1,1,1-TRIFLUORO-2-[(4-METHOXYPHENYL)FORMAMIDO]-3-OXOPROPAN-2-YL}AMINO)-4,5,6,7-TETRAHYDRO-1-BENZOTHIOPHENE-3-CARBOXYLATE
| Molecular Formula | C23H25F3N2O6S |
|---|---|
| Molecular Weight | 514.14 g/mol |
| LogP | 4.0857 |
| Topological Polar Surface Area | 102.96 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 514.13855 |
| Heavy Atoms | 35 |
| Complexity | 1099.9116 |
Chemical Identifiers
| CAS Number | 298683-67-7 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC1=C(C2=C(S1)CCCC2)C(=O)OC)NC(=O)C3=CC=C(C=C3)OC |
Product Overview
A2146/0090125 (CAS 298683-67-7), with molecular formula C23H25F3N2O6S and molecular weight 514.14 g/mol. IUPAC: methyl 2-[[3-ethoxy-1,1,1-trifluoro-2-[(4-methoxybenzoyl)amino]-3-oxopropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of A2146/0090125
Property Insights of A2146/0090125
The XLogP value of 4.0857 indicates that A2146/0090125 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 A2146/0090125. Following Lipinski's Rule of Five, A2146/0090125 has 2 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A2146/0090125?
The CAS number of A2146/0090125 is 298683-67-7.
What is the molecular formula of A2146/0090125?
The molecular formula of A2146/0090125 is C23H25F3N2O6S.
What is the molecular weight of A2146/0090125?
The molecular weight of A2146/0090125 is 514.14 g/mol.
Where can I buy A2146/0090125?
You can request a quote for A2146/0090125 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A2146/0090125?
Yes, KEHONG BIO provides custom synthesis services for A2146/0090125 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.