F0566-0401
TL;DR: F0566-0401 (CAS 850910-94-0) is a chemical compound with molecular formula C22H21N5O3S2 and molecular weight 467.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[bis(2-cyanoethyl)sulfamoyl]-N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)benzamide
Also Known As: F0566-0401, (E)-4-(N,N-bis(2-cyanoethyl)sulfamoyl)-N-(3,4-dimethylbenzo[d]thiazol-2(3H)-ylidene)benzamide, 4-[bis(2-cyanoethyl)sulfamoyl]-N-[(2E)-3,4-dimethyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzamide, 4-[bis(2-cyanoethyl)sulfamoyl]-N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)benzamide, 4-[bis(2-cyanoethyl)sulfamoyl]-N-(3,4-dimethylbenzothiazol-2-ylidene)benzamide
| Molecular Formula | C22H21N5O3S2 |
|---|---|
| Molecular Weight | 467.11 g/mol |
| LogP | 3.10738 |
| Topological Polar Surface Area | 119.32 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 467.10858 |
| Heavy Atoms | 32 |
| Complexity | 1386.9929 |
Chemical Identifiers
| CAS Number | 850910-94-0 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)SC(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N(CCC#N)CCC#N)N2C |
Product Overview
F0566-0401 (CAS 850910-94-0), with molecular formula C22H21N5O3S2 and molecular weight 467.11 g/mol. IUPAC: 4-[bis(2-cyanoethyl)sulfamoyl]-N-(3,4-dimethyl-1,3-benzothiazol-2-ylidene)benzamide.
Chemical Property Profile of F0566-0401
Property Insights of F0566-0401
The XLogP value of 3.10738 indicates that F0566-0401 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 119.32 Ų falls within the moderate polarity range, balancing permeability and solubility for F0566-0401. Following Lipinski's Rule of Five, F0566-0401 has 0 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 F0566-0401?
The CAS number of F0566-0401 is 850910-94-0.
What is the molecular formula of F0566-0401?
The molecular formula of F0566-0401 is C22H21N5O3S2.
What is the molecular weight of F0566-0401?
The molecular weight of F0566-0401 is 467.11 g/mol.
Where can I buy F0566-0401?
You can request a quote for F0566-0401 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0566-0401?
Yes, KEHONG BIO provides custom synthesis services for F0566-0401 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.