ChemDiv1_005940
TL;DR: ChemDiv1_005940 (CAS 389138-63-0) is a chemical compound with molecular formula C23H25FN4O3S and molecular weight 456.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)imino-3-methyl-1,3-thiazinan-4-one
Also Known As: ChemDiv1_005940, BIM-0041924.P001, (2E)-6-{[4-(4-fluorophenyl)piperazin-1-yl]carbonyl}-2-[(4-methoxyphenyl)imino]-3-methyl-1,3-thiazinan-4-one, (E)-6-(4-(4-fluorophenyl)piperazine-1-carbonyl)-2-((4-methoxyphenyl)imino)-3-methyl-1,3-thiazinan-4-one, 6-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)imino-3-methyl-1,3-thiazinan-4-one
| Molecular Formula | C23H25FN4O3S |
|---|---|
| Molecular Weight | 456.16 g/mol |
| LogP | 3.1345 |
| Topological Polar Surface Area | 65.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 456.16315 |
| Heavy Atoms | 32 |
| Complexity | 1004.9065 |
Chemical Identifiers
| CAS Number | 389138-63-0 |
|---|---|
| SMILES | CN1C(=O)CC(SC1=NC2=CC=C(C=C2)OC)C(=O)N3CCN(CC3)C4=CC=C(C=C4)F |
Product Overview
ChemDiv1_005940 (CAS 389138-63-0), with molecular formula C23H25FN4O3S and molecular weight 456.16 g/mol. IUPAC: 6-[4-(4-fluorophenyl)piperazine-1-carbonyl]-2-(4-methoxyphenyl)imino-3-methyl-1,3-thiazinan-4-one.
Chemical Property Profile of ChemDiv1_005940
Property Insights of ChemDiv1_005940
The XLogP value of 3.1345 indicates that ChemDiv1_005940 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.45 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_005940. Following Lipinski's Rule of Five, ChemDiv1_005940 has 0 hydrogen bond donor(s) and 6 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_005940?
The CAS number of ChemDiv1_005940 is 389138-63-0.
What is the molecular formula of ChemDiv1_005940?
The molecular formula of ChemDiv1_005940 is C23H25FN4O3S.
What is the molecular weight of ChemDiv1_005940?
The molecular weight of ChemDiv1_005940 is 456.16 g/mol.
Where can I buy ChemDiv1_005940?
You can request a quote for ChemDiv1_005940 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_005940?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_005940 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.