Neuronotoxicity-IN-1
TL;DR: Neuronotoxicity-IN-1 (CAS 190843-45-9) is a chemical compound with molecular formula C17H15N3OS and molecular weight 309.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methyl-N-prop-2-enylanilino)pyrido[3,2-e][1,3]thiazin-4-one
Also Known As: Neuronotoxicity-IN-1, 2-(4-methyl-N-prop-2-enylanilino)pyrido[3,2-e][1,3]thiazin-4-one, 2-(Allyl(p-tolyl)amino)-4H-pyrido[3,2-e][1,3]thiazin-4-one, 8-[(4-methylphenyl)-prop-2-enyl-amino]-7-thia-5,9-diazabicyclo[4.4.0]deca-2,4,8,11-tetraen-10-one
| Molecular Formula | C17H15N3OS |
|---|---|
| Molecular Weight | 309.09 g/mol |
| LogP | 3.68402 |
| Topological Polar Surface Area | 46.09 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 309.0936 |
| Heavy Atoms | 22 |
| Complexity | 870.9565 |
Chemical Identifiers
| CAS Number | 190843-45-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N(CC=C)C2=NC(=O)C3=C(S2)N=CC=C3 |
Product Overview
Neuronotoxicity-IN-1 (CAS 190843-45-9), with molecular formula C17H15N3OS and molecular weight 309.09 g/mol. IUPAC: 2-(4-methyl-N-prop-2-enylanilino)pyrido[3,2-e][1,3]thiazin-4-one.
Chemical Property Profile of Neuronotoxicity-IN-1
Property Insights of Neuronotoxicity-IN-1
The XLogP value of 3.68402 indicates that Neuronotoxicity-IN-1 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.09 Ų, Neuronotoxicity-IN-1 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Neuronotoxicity-IN-1 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 Neuronotoxicity-IN-1?
The CAS number of Neuronotoxicity-IN-1 is 190843-45-9.
What is the molecular formula of Neuronotoxicity-IN-1?
The molecular formula of Neuronotoxicity-IN-1 is C17H15N3OS.
What is the molecular weight of Neuronotoxicity-IN-1?
The molecular weight of Neuronotoxicity-IN-1 is 309.09 g/mol.
Where can I buy Neuronotoxicity-IN-1?
You can request a quote for Neuronotoxicity-IN-1 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neuronotoxicity-IN-1?
Yes, KEHONG BIO provides custom synthesis services for Neuronotoxicity-IN-1 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.