F1816-0433
TL;DR: F1816-0433 (CAS 868377-76-8) is a chemical compound with molecular formula C17H13N3O4S and molecular weight 355.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide
Also Known As: F1816-0433, N-[(2Z)-5,7-dimethyl-3-(prop-2-yn-1-yl)-2,3-dihydro-1,3-benzothiazol-2-ylidene]-5-nitrofuran-2-carboxamide, N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide, (Z)-N-(5,7-dimethyl-3-(prop-2-yn-1-yl)benzo[d]thiazol-2(3H)-ylidene)-5-nitrofuran-2-carboxamide
| Molecular Formula | C17H13N3O4S |
|---|---|
| Molecular Weight | 355.06 g/mol |
| LogP | 3.19514 |
| Topological Polar Surface Area | 90.64 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 355.06268 |
| Heavy Atoms | 25 |
| Complexity | 1111.2987 |
Chemical Identifiers
| CAS Number | 868377-76-8 |
|---|---|
| SMILES | CC1=CC(=C2C(=C1)N(C(=NC(=O)C3=CC=C(O3)[N+](=O)[O-])S2)CC#C)C |
Product Overview
F1816-0433 (CAS 868377-76-8), with molecular formula C17H13N3O4S and molecular weight 355.06 g/mol. IUPAC: N-(5,7-dimethyl-3-prop-2-ynyl-1,3-benzothiazol-2-ylidene)-5-nitrofuran-2-carboxamide.
Chemical Property Profile of F1816-0433
Property Insights of F1816-0433
The XLogP value of 3.19514 indicates that F1816-0433 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.64 Ų falls within the moderate polarity range, balancing permeability and solubility for F1816-0433. Following Lipinski's Rule of Five, F1816-0433 has 0 hydrogen bond donor(s) and 5 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 F1816-0433?
The CAS number of F1816-0433 is 868377-76-8.
What is the molecular formula of F1816-0433?
The molecular formula of F1816-0433 is C17H13N3O4S.
What is the molecular weight of F1816-0433?
The molecular weight of F1816-0433 is 355.06 g/mol.
Where can I buy F1816-0433?
You can request a quote for F1816-0433 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F1816-0433?
Yes, KEHONG BIO provides custom synthesis services for F1816-0433 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.