IFLab1_004077
TL;DR: IFLab1_004077 (CAS 443329-45-1) is a chemical compound with molecular formula C19H16N2O4S and molecular weight 368.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-oxochromene-2-carboxamide
Also Known As: IFLab1_004077, AB00685351-01, F0866-0187, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydrobenzo[d]thiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide, N-(5,5-dimethyl-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-4-oxo-4H-chromene-2-carboxamide
| Molecular Formula | C19H16N2O4S |
|---|---|
| Molecular Weight | 368.08 g/mol |
| LogP | 3.6569 |
| Topological Polar Surface Area | 89.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 368.08307 |
| Heavy Atoms | 26 |
| Complexity | 1110.1698 |
Chemical Identifiers
| CAS Number | 443329-45-1 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)C3=CC(=O)C4=CC=CC=C4O3)C |
Product Overview
IFLab1_004077 (CAS 443329-45-1), with molecular formula C19H16N2O4S and molecular weight 368.08 g/mol. IUPAC: N-(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)-4-oxochromene-2-carboxamide.
Chemical Property Profile of IFLab1_004077
Property Insights of IFLab1_004077
The XLogP value of 3.6569 indicates that IFLab1_004077 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.27 Ų falls within the moderate polarity range, balancing permeability and solubility for IFLab1_004077. Following Lipinski's Rule of Five, IFLab1_004077 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 IFLab1_004077?
The CAS number of IFLab1_004077 is 443329-45-1.
What is the molecular formula of IFLab1_004077?
The molecular formula of IFLab1_004077 is C19H16N2O4S.
What is the molecular weight of IFLab1_004077?
The molecular weight of IFLab1_004077 is 368.08 g/mol.
Where can I buy IFLab1_004077?
You can request a quote for IFLab1_004077 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for IFLab1_004077?
Yes, KEHONG BIO provides custom synthesis services for IFLab1_004077 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.