F0816-0086
TL;DR: F0816-0086 (CAS 477485-89-5) is a chemical compound with molecular formula C24H22N4O3S3 and molecular weight 510.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: F0816-0086, 3-[(2Z)-3-methyl-2H,3H-naphtho[2,1-d][1,3]thiazol-2-ylidene]-1-[4-(pyrrolidine-1-sulfonyl)benzoyl]thiourea, N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide, p-{[(Z)-3-{5-methyl-3-thia-5-azatricyclo[7.4.0.0(2),]trideca-1(9),2(6),7,10,12-pentaen-4-ylidene}thioureido]carbonyl}phenyl(oxo)-1-pyrrolidinyl-lambda-sulfaniumolate
| Molecular Formula | C24H22N4O3S3 |
|---|---|
| Molecular Weight | 510.09 g/mol |
| LogP | 3.7931 |
| Topological Polar Surface Area | 83.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 510.08542 |
| Heavy Atoms | 34 |
| Complexity | 1596.2924 |
Chemical Identifiers
| CAS Number | 477485-89-5 |
|---|---|
| SMILES | CN1C2=C(C3=CC=CC=C3C=C2)SC1=NC(=S)NC(=O)C4=CC=C(C=C4)S(=O)(=O)N5CCCC5 |
Product Overview
F0816-0086 (CAS 477485-89-5), with molecular formula C24H22N4O3S3 and molecular weight 510.09 g/mol. IUPAC: N-[(3-methylbenzo[g][1,3]benzothiazol-2-ylidene)carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0816-0086
Property Insights of F0816-0086
The XLogP value of 3.7931 indicates that F0816-0086 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.77 Ų falls within the moderate polarity range, balancing permeability and solubility for F0816-0086. Following Lipinski's Rule of Five, F0816-0086 has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0816-0086?
The CAS number of F0816-0086 is 477485-89-5.
What is the molecular formula of F0816-0086?
The molecular formula of F0816-0086 is C24H22N4O3S3.
What is the molecular weight of F0816-0086?
The molecular weight of F0816-0086 is 510.09 g/mol.
Where can I buy F0816-0086?
You can request a quote for F0816-0086 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0816-0086?
Yes, KEHONG BIO provides custom synthesis services for F0816-0086 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.