ChemDiv1_011924
TL;DR: ChemDiv1_011924 (CAS 6048-78-8) is a chemical compound with molecular formula C22H25N5O3S and molecular weight 439.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methoxyphenyl)imino-3-methyl-6-(4-pyridin-2-ylpiperazine-1-carbonyl)-1,3-thiazinan-4-one
Also Known As: ChemDiv1_011924, BIM-0042573.P001, A2225/0093712, 2-(4-methoxyphenyl)imino-3-methyl-6-(4-pyridin-2-ylpiperazine-1-carbonyl)-1,3-thiazinan-4-one, 2-[(4-methoxyphenyl)imino]-3-methyl-6-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}-1,3-thiazinan-4-one
| Molecular Formula | C22H25N5O3S |
|---|---|
| Molecular Weight | 439.17 g/mol |
| LogP | 2.3904 |
| Topological Polar Surface Area | 78.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 439.16782 |
| Heavy Atoms | 31 |
| Complexity | 958.87146 |
Chemical Identifiers
| CAS Number | 6048-78-8 |
|---|---|
| SMILES | CN1C(=O)CC(SC1=NC2=CC=C(C=C2)OC)C(=O)N3CCN(CC3)C4=CC=CC=N4 |
Product Overview
ChemDiv1_011924 (CAS 6048-78-8), with molecular formula C22H25N5O3S and molecular weight 439.17 g/mol. IUPAC: 2-(4-methoxyphenyl)imino-3-methyl-6-(4-pyridin-2-ylpiperazine-1-carbonyl)-1,3-thiazinan-4-one.
Chemical Property Profile of ChemDiv1_011924
Property Insights of ChemDiv1_011924
The XLogP value of 2.3904 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_011924. The TPSA of 78.34 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_011924. Following Lipinski's Rule of Five, ChemDiv1_011924 has 0 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 ChemDiv1_011924?
The CAS number of ChemDiv1_011924 is 6048-78-8.
What is the molecular formula of ChemDiv1_011924?
The molecular formula of ChemDiv1_011924 is C22H25N5O3S.
What is the molecular weight of ChemDiv1_011924?
The molecular weight of ChemDiv1_011924 is 439.17 g/mol.
Where can I buy ChemDiv1_011924?
You can request a quote for ChemDiv1_011924 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_011924?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_011924 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.