Ros inhibitor
TL;DR: Ros inhibitor (CAS 330997-95-0) is a chemical compound with molecular formula C19H25N5O4S and molecular weight 419.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-N-[(E)-1-(4-pentoxyphenyl)ethylideneamino]acetamide
Also Known As: Ros inhibitor, YCG063, YCG 063, BAS 00327549
| Molecular Formula | C19H25N5O4S |
|---|---|
| Molecular Weight | 419.16 g/mol |
| LogP | 3.5298 |
| Topological Polar Surface Area | 111.65 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 419.16272 |
| Heavy Atoms | 29 |
| Complexity | 863.9845 |
Chemical Identifiers
| CAS Number | 330997-95-0 |
|---|---|
| SMILES | CCCCCOC1=CC=C(C=C1)/C(=N/NC(=O)CSC2=C(N=CN2C)[N+](=O)[O-])/C |
Product Overview
Ros inhibitor (CAS 330997-95-0), with molecular formula C19H25N5O4S and molecular weight 419.16 g/mol. IUPAC: 2-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-N-[(E)-1-(4-pentoxyphenyl)ethylideneamino]acetamide.
Chemical Property Profile of Ros inhibitor
Property Insights of Ros inhibitor
The XLogP value of 3.5298 indicates that Ros inhibitor is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 111.65 Ų falls within the moderate polarity range, balancing permeability and solubility for Ros inhibitor. Following Lipinski's Rule of Five, Ros inhibitor 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 Ros inhibitor?
The CAS number of Ros inhibitor is 330997-95-0.
What is the molecular formula of Ros inhibitor?
The molecular formula of Ros inhibitor is C19H25N5O4S.
What is the molecular weight of Ros inhibitor?
The molecular weight of Ros inhibitor is 419.16 g/mol.
Where can I buy Ros inhibitor?
You can request a quote for Ros inhibitor directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ros inhibitor?
Yes, KEHONG BIO provides custom synthesis services for Ros inhibitor and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.