![ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate structure](/static/products/6621/662162-90-5.webp)
ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate
TL;DR: ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate (CAS 662162-90-5) is a chemical compound with molecular formula C18H16ClN3O3S and molecular weight 389.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-2-chlorobenzoate
Also Known As: CBKinase1_004763, CBKinase1_017163, AH-487/42192766, BRD-K60630697-001-01-2, ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate
| Molecular Formula | C18H16ClN3O3S |
|---|---|
| Molecular Weight | 389.06 g/mol |
| LogP | 4.1238 |
| Topological Polar Surface Area | 84.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 389.0601 |
| Heavy Atoms | 26 |
| Complexity | 924.7592 |
Chemical Identifiers
| CAS Number | 662162-90-5 |
|---|---|
| SMILES | CCOC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC3=CC=CC=C3N2)Cl |
Product Overview
ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate (CAS 662162-90-5), with molecular formula C18H16ClN3O3S and molecular weight 389.06 g/mol. IUPAC: ethyl 5-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-2-chlorobenzoate.
Chemical Property Profile of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate
Property Insights of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate
The XLogP value of 4.1238 indicates that ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.08 Ų falls within the moderate polarity range, balancing permeability and solubility for ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate. Following Lipinski's Rule of Five, ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate has 2 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 ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate?
The CAS number of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate is 662162-90-5.
What is the molecular formula of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate?
The molecular formula of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate is C18H16ClN3O3S.
What is the molecular weight of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate?
The molecular weight of ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate is 389.06 g/mol.
Where can I buy ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate?
You can request a quote for ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for ethyl 5-{[(1H-benzimidazol-2-ylsulfanyl)acetyl]amino}-2-chlorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.