F0806-0683
TL;DR: F0806-0683 (CAS 477495-37-7) is a chemical compound with molecular formula C20H17ClN2O3S3 and molecular weight 464.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Also Known As: F0806-0683, AN-329/41573513, ethyl 2-(3-(3-chlorobenzo[b]thiophene-2-carbonyl)thioureido)-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate, ETHYL 2-({[(3-CHLORO-1-BENZOTHIOPHEN-2-YL)FORMAMIDO]METHANETHIOYL}AMINO)-4H,5H,6H-CYCLOPENTA[B]THIOPHENE-3-CARBOXYLATE, ethyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
| Molecular Formula | C20H17ClN2O3S3 |
|---|---|
| Molecular Weight | 464.01 g/mol |
| LogP | 5.4084 |
| Topological Polar Surface Area | 67.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 464.00897 |
| Heavy Atoms | 29 |
| Complexity | 1135.6418 |
Chemical Identifiers
| CAS Number | 477495-37-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC2=C1CCC2)NC(=S)NC(=O)C3=C(C4=CC=CC=C4S3)Cl |
Product Overview
F0806-0683 (CAS 477495-37-7), with molecular formula C20H17ClN2O3S3 and molecular weight 464.01 g/mol. IUPAC: ethyl 2-[(3-chloro-1-benzothiophene-2-carbonyl)carbamothioylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate.
Chemical Property Profile of F0806-0683
Property Insights of F0806-0683
The XLogP value of 5.4084 indicates that F0806-0683 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.43 Ų falls within the moderate polarity range, balancing permeability and solubility for F0806-0683. Following Lipinski's Rule of Five, F0806-0683 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0806-0683?
The CAS number of F0806-0683 is 477495-37-7.
What is the molecular formula of F0806-0683?
The molecular formula of F0806-0683 is C20H17ClN2O3S3.
What is the molecular weight of F0806-0683?
The molecular weight of F0806-0683 is 464.01 g/mol.
Where can I buy F0806-0683?
You can request a quote for F0806-0683 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0806-0683?
Yes, KEHONG BIO provides custom synthesis services for F0806-0683 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.