F0816-0455
TL;DR: F0816-0455 (CAS 397289-26-8) is a chemical compound with molecular formula C24H20N4O5S3 and molecular weight 540.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide
Also Known As: F0816-0455, 3-[4-(2-oxo-2H-chromen-3-yl)-1,3-thiazol-2-yl]-1-[4-(pyrrolidine-1-sulfonyl)benzoyl]thiourea, N-[[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide, N-((4-(2-oxo-2H-chromen-3-yl)thiazol-2-yl)carbamothioyl)-4-(pyrrolidin-1-ylsulfonyl)benzamide, N-[[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]thiocarbamoyl]-4-pyrrolidin-1-ylsulfonyl-benzamide
| Molecular Formula | C24H20N4O5S3 |
|---|---|
| Molecular Weight | 540.06 g/mol |
| LogP | 3.8278 |
| Topological Polar Surface Area | 121.61 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 540.0596 |
| Heavy Atoms | 36 |
| Complexity | 1621.5215 |
Chemical Identifiers
| CAS Number | 397289-26-8 |
|---|---|
| SMILES | C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC(=S)NC3=NC(=CS3)C4=CC5=CC=CC=C5OC4=O |
Product Overview
F0816-0455 (CAS 397289-26-8), with molecular formula C24H20N4O5S3 and molecular weight 540.06 g/mol. IUPAC: N-[[4-(2-oxochromen-3-yl)-1,3-thiazol-2-yl]carbamothioyl]-4-pyrrolidin-1-ylsulfonylbenzamide.
Chemical Property Profile of F0816-0455
Property Insights of F0816-0455
The XLogP value of 3.8278 indicates that F0816-0455 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 121.61 Ų falls within the moderate polarity range, balancing permeability and solubility for F0816-0455. Following Lipinski's Rule of Five, F0816-0455 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 F0816-0455?
The CAS number of F0816-0455 is 397289-26-8.
What is the molecular formula of F0816-0455?
The molecular formula of F0816-0455 is C24H20N4O5S3.
What is the molecular weight of F0816-0455?
The molecular weight of F0816-0455 is 540.06 g/mol.
Where can I buy F0816-0455?
You can request a quote for F0816-0455 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0816-0455?
Yes, KEHONG BIO provides custom synthesis services for F0816-0455 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.