AB00105610-01
TL;DR: AB00105610-01 (CAS 345254-08-2) is a chemical compound with molecular formula C22H23N3O3S2 and molecular weight 441.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide
Also Known As: AB00105610-01, 2-methyl-N-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide, 2-methyl-N-(2-((2-oxo-2-(((tetrahydrofuran-2-yl)methyl)amino)ethyl)thio)benzo[d]thiazol-6-yl)benzamide, 2-methyl-N-[2-({2-oxo-2-[(tetrahydrofuran-2-ylmethyl)amino]ethyl}sulfanyl)-1,3-benzothiazol-6-yl]benzamide
| Molecular Formula | C22H23N3O3S2 |
|---|---|
| Molecular Weight | 441.12 g/mol |
| LogP | 4.24432 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 441.11807 |
| Heavy Atoms | 30 |
| Complexity | 1060.7173 |
Chemical Identifiers
| CAS Number | 345254-08-2 |
|---|---|
| SMILES | CC1=CC=CC=C1C(=O)NC2=CC3=C(C=C2)N=C(S3)SCC(=O)NCC4CCCO4 |
Product Overview
AB00105610-01 (CAS 345254-08-2), with molecular formula C22H23N3O3S2 and molecular weight 441.12 g/mol. IUPAC: 2-methyl-N-[2-[2-oxo-2-(oxolan-2-ylmethylamino)ethyl]sulfanyl-1,3-benzothiazol-6-yl]benzamide.
Chemical Property Profile of AB00105610-01
Property Insights of AB00105610-01
The XLogP value of 4.24432 indicates that AB00105610-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00105610-01. Following Lipinski's Rule of Five, AB00105610-01 has 2 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 AB00105610-01?
The CAS number of AB00105610-01 is 345254-08-2.
What is the molecular formula of AB00105610-01?
The molecular formula of AB00105610-01 is C22H23N3O3S2.
What is the molecular weight of AB00105610-01?
The molecular weight of AB00105610-01 is 441.12 g/mol.
Where can I buy AB00105610-01?
You can request a quote for AB00105610-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00105610-01?
Yes, KEHONG BIO provides custom synthesis services for AB00105610-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.