ASN 06942804
TL;DR: ASN 06942804 (CAS 606121-00-0) is a chemical compound with molecular formula C21H20ClN5O2S and molecular weight 441.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-[(4-chlorophenyl)methyl]-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl]sulfanyl]-1-morpholin-4-ylethanone
Also Known As: ASN 06942804, Morpholine, 4-[[[9-[(4-chlorophenyl)methyl]-9H-1,2,4-triazolo[4,3-a]benzimidazol-3-yl]thio]acetyl]- (9CI), Morpholine,4-[[[9-[ methyl]-9H-1,2,4-triazolo[4,3-a]benzimidazol-3-yl]thio]acetyl]-, 2-[[4-[(4-chlorophenyl)methyl]-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl]sulfanyl]-1-morpholin-4-ylethanone, Morpholine, 4-[[[9-[(4-chlorophenyl)methyl]-9H-1,2,4-triazolo[4,3-a]benzimidazol-3-yl]thio]acetyl]-
| Molecular Formula | C21H20ClN5O2S |
|---|---|
| Molecular Weight | 441.10 g/mol |
| LogP | 3.3366 |
| Topological Polar Surface Area | 64.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 441.10263 |
| Heavy Atoms | 30 |
| Complexity | 1197.5336 |
Chemical Identifiers
| CAS Number | 606121-00-0 |
|---|---|
| SMILES | C1COCCN1C(=O)CSC2=NN=C3N2C4=CC=CC=C4N3CC5=CC=C(C=C5)Cl |
Product Overview
ASN 06942804 (CAS 606121-00-0), with molecular formula C21H20ClN5O2S and molecular weight 441.10 g/mol. IUPAC: 2-[[4-[(4-chlorophenyl)methyl]-[1,2,4]triazolo[4,3-a]benzimidazol-1-yl]sulfanyl]-1-morpholin-4-ylethanone.
Chemical Property Profile of ASN 06942804
Property Insights of ASN 06942804
The XLogP value of 3.3366 indicates that ASN 06942804 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.66 Ų falls within the moderate polarity range, balancing permeability and solubility for ASN 06942804. Following Lipinski's Rule of Five, ASN 06942804 has 0 hydrogen bond donor(s) and 5 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 ASN 06942804?
The CAS number of ASN 06942804 is 606121-00-0.
What is the molecular formula of ASN 06942804?
The molecular formula of ASN 06942804 is C21H20ClN5O2S.
What is the molecular weight of ASN 06942804?
The molecular weight of ASN 06942804 is 441.10 g/mol.
Where can I buy ASN 06942804?
You can request a quote for ASN 06942804 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ASN 06942804?
Yes, KEHONG BIO provides custom synthesis services for ASN 06942804 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.