F0550-0114
TL;DR: F0550-0114 (CAS 497072-53-4) is a chemical compound with molecular formula C13H9ClN4O4S and molecular weight 352.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5-chloro-2-nitrophenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Also Known As: F0550-0114, N-(5-chloro-2-nitrophenyl)-5-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxamide, N-(5-chloro-2-nitrophenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide, N-(5-chloro-2-nitrophenyl)-5-oxo-2H,3H,5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide, N-(5-chloro-2-nitrophenyl)-4-oxo-1-thia-3a,7-diaza-5-indancarboxamide
| Molecular Formula | C13H9ClN4O4S |
|---|---|
| Molecular Weight | 352.00 g/mol |
| LogP | 2.1629 |
| Topological Polar Surface Area | 107.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0033 |
| Heavy Atoms | 23 |
| Complexity | 882.7636 |
Chemical Identifiers
| CAS Number | 497072-53-4 |
|---|---|
| SMILES | C1CSC2=NC=C(C(=O)N21)C(=O)NC3=C(C=CC(=C3)Cl)[N+](=O)[O-] |
Product Overview
F0550-0114 (CAS 497072-53-4), with molecular formula C13H9ClN4O4S and molecular weight 352.00 g/mol. IUPAC: N-(5-chloro-2-nitrophenyl)-5-oxo-2,3-dihydro-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide.
Chemical Property Profile of F0550-0114
Property Insights of F0550-0114
The XLogP value of 2.1629 suggests moderate lipophilicity, balancing water solubility and membrane permeability for F0550-0114. The TPSA of 107.13 Ų falls within the moderate polarity range, balancing permeability and solubility for F0550-0114. Following Lipinski's Rule of Five, F0550-0114 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 F0550-0114?
The CAS number of F0550-0114 is 497072-53-4.
What is the molecular formula of F0550-0114?
The molecular formula of F0550-0114 is C13H9ClN4O4S.
What is the molecular weight of F0550-0114?
The molecular weight of F0550-0114 is 352.00 g/mol.
Where can I buy F0550-0114?
You can request a quote for F0550-0114 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0550-0114?
Yes, KEHONG BIO provides custom synthesis services for F0550-0114 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.