F0866-0469
TL;DR: F0866-0469 (CAS 477548-55-3) is a chemical compound with molecular formula C21H23NO5S and molecular weight 401.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(4-methoxycarbonylbenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Also Known As: F0866-0469, ethyl 2-(4-(methoxycarbonyl)benzamido)-6-methyl-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate, ethyl 2-[4-(methoxycarbonyl)benzamido]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-[(4-methoxycarbonylbenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate, ethyl 2-(p-methoxycarbonylbenzylamino)-6-methyl-1-thia-4,5,6,7-tetrahydro-3-indenecarboxylate
| Molecular Formula | C21H23NO5S |
|---|---|
| Molecular Weight | 401.13 g/mol |
| LogP | 4.0885 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 401.1297 |
| Heavy Atoms | 28 |
| Complexity | 900.2649 |
Chemical Identifiers
| CAS Number | 477548-55-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C3=CC=C(C=C3)C(=O)OC |
Product Overview
F0866-0469 (CAS 477548-55-3), with molecular formula C21H23NO5S and molecular weight 401.13 g/mol. IUPAC: ethyl 2-[(4-methoxycarbonylbenzoyl)amino]-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate.
Chemical Property Profile of F0866-0469
Property Insights of F0866-0469
The XLogP value of 4.0885 indicates that F0866-0469 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for F0866-0469. Following Lipinski's Rule of Five, F0866-0469 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0866-0469?
The CAS number of F0866-0469 is 477548-55-3.
What is the molecular formula of F0866-0469?
The molecular formula of F0866-0469 is C21H23NO5S.
What is the molecular weight of F0866-0469?
The molecular weight of F0866-0469 is 401.13 g/mol.
Where can I buy F0866-0469?
You can request a quote for F0866-0469 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0866-0469?
Yes, KEHONG BIO provides custom synthesis services for F0866-0469 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.