BAS 04944922
TL;DR: BAS 04944922 (CAS 497241-99-3) is a chemical compound with molecular formula C22H23N5O2S3 and molecular weight 485.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]acetamide
Also Known As: BAS 04944922, AN-988/40788155, 2-(1H-benzimidazol-2-ylsulfanyl)-N-(2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}-1,3-benzothiazol-6-yl)acetamide, 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]acetamide, 2-[6-(2-benzimidazol-2-ylthioacetylamino)benzothiazol-2-ylthio]-N-(tert-butyl) acetamide
| Molecular Formula | C22H23N5O2S3 |
|---|---|
| Molecular Weight | 485.10 g/mol |
| LogP | 4.9102 |
| Topological Polar Surface Area | 99.77 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 485.10138 |
| Heavy Atoms | 32 |
| Complexity | 1242.5383 |
Chemical Identifiers
| CAS Number | 497241-99-3 |
|---|---|
| SMILES | CC(C)(C)NC(=O)CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CSC3=NC4=CC=CC=C4N3 |
Product Overview
BAS 04944922 (CAS 497241-99-3), with molecular formula C22H23N5O2S3 and molecular weight 485.10 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-N-[2-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-1,3-benzothiazol-6-yl]acetamide.
Chemical Property Profile of BAS 04944922
Property Insights of BAS 04944922
The XLogP value of 4.9102 indicates that BAS 04944922 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.77 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 04944922. Following Lipinski's Rule of Five, BAS 04944922 has 3 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 BAS 04944922?
The CAS number of BAS 04944922 is 497241-99-3.
What is the molecular formula of BAS 04944922?
The molecular formula of BAS 04944922 is C22H23N5O2S3.
What is the molecular weight of BAS 04944922?
The molecular weight of BAS 04944922 is 485.10 g/mol.
Where can I buy BAS 04944922?
You can request a quote for BAS 04944922 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 04944922?
Yes, KEHONG BIO provides custom synthesis services for BAS 04944922 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.