F0599-0554
TL;DR: F0599-0554 (CAS 851079-54-4) is a chemical compound with molecular formula C18H14N4O5S and molecular weight 398.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1,3-benzodioxol-5-yl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide
Also Known As: F0599-0554, N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(4-nitrophenyl)-1H-imidazol-2-yl]sulfanyl}acetamide, N-(benzo[d][1,3]dioxol-5-yl)-2-((1-(4-nitrophenyl)-1H-imidazol-2-yl)thio)acetamide, N-(1,3-benzodioxol-5-yl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide, N-(2H-1,3-benzodioxol-5-yl)[1-(p-nitrophenyl)-2-imidazolylthio]acetamide
| Molecular Formula | C18H14N4O5S |
|---|---|
| Molecular Weight | 398.07 g/mol |
| LogP | 3.24 |
| Topological Polar Surface Area | 108.52 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.06848 |
| Heavy Atoms | 28 |
| Complexity | 1034.7102 |
Chemical Identifiers
| CAS Number | 851079-54-4 |
|---|---|
| SMILES | C1OC2=C(O1)C=C(C=C2)NC(=O)CSC3=NC=CN3C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
F0599-0554 (CAS 851079-54-4), with molecular formula C18H14N4O5S and molecular weight 398.07 g/mol. IUPAC: N-(1,3-benzodioxol-5-yl)-2-[1-(4-nitrophenyl)imidazol-2-yl]sulfanylacetamide.
Chemical Property Profile of F0599-0554
Property Insights of F0599-0554
The XLogP value of 3.24 indicates that F0599-0554 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.52 Ų falls within the moderate polarity range, balancing permeability and solubility for F0599-0554. Following Lipinski's Rule of Five, F0599-0554 has 1 hydrogen bond donor(s) and 7 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 F0599-0554?
The CAS number of F0599-0554 is 851079-54-4.
What is the molecular formula of F0599-0554?
The molecular formula of F0599-0554 is C18H14N4O5S.
What is the molecular weight of F0599-0554?
The molecular weight of F0599-0554 is 398.07 g/mol.
Where can I buy F0599-0554?
You can request a quote for F0599-0554 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0599-0554?
Yes, KEHONG BIO provides custom synthesis services for F0599-0554 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.