ChemDiv2_003781
TL;DR: ChemDiv2_003781 (CAS 308297-83-8) is a chemical compound with molecular formula C24H24N2O3S and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-8-[(3-methylpiperidin-1-yl)methyl]chromen-4-one
Also Known As: ChemDiv2_003781, IDI1_002496, 3-(benzo[d]thiazol-2-yl)-7-hydroxy-2-methyl-8-((3-methylpiperidin-1-yl)methyl)-4H-chromen-4-one, 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-8-[(3-methylpiperidin-1-yl)methyl]-4H-chromen-4-one, F0821-0233
| Molecular Formula | C24H24N2O3S |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 5.31562 |
| Topological Polar Surface Area | 66.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 420.15076 |
| Heavy Atoms | 30 |
| Complexity | 1274.2894 |
Chemical Identifiers
| CAS Number | 308297-83-8 |
|---|---|
| SMILES | CC1CCCN(C1)CC2=C(C=CC3=C2OC(=C(C3=O)C4=NC5=CC=CC=C5S4)C)O |
Product Overview
ChemDiv2_003781 (CAS 308297-83-8), with molecular formula C24H24N2O3S and molecular weight 420.15 g/mol. IUPAC: 3-(1,3-benzothiazol-2-yl)-7-hydroxy-2-methyl-8-[(3-methylpiperidin-1-yl)methyl]chromen-4-one.
Chemical Property Profile of ChemDiv2_003781
Property Insights of ChemDiv2_003781
The XLogP value of 5.31562 indicates that ChemDiv2_003781 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.57 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv2_003781. Following Lipinski's Rule of Five, ChemDiv2_003781 has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv2_003781?
The CAS number of ChemDiv2_003781 is 308297-83-8.
What is the molecular formula of ChemDiv2_003781?
The molecular formula of ChemDiv2_003781 is C24H24N2O3S.
What is the molecular weight of ChemDiv2_003781?
The molecular weight of ChemDiv2_003781 is 420.15 g/mol.
Where can I buy ChemDiv2_003781?
You can request a quote for ChemDiv2_003781 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv2_003781?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv2_003781 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.