A4101/0174857
TL;DR: A4101/0174857 (CAS 1009526-35-5) is a chemical compound with molecular formula C19H25N3O3S and molecular weight 375.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-2-phenylacetate
Also Known As: A4101/0174857, methyl ({[(5-butyl-4-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)(phenyl)acetate, methyl 2-(2-((5-butyl-4-methyl-1H-imidazol-2-yl)thio)acetamido)-2-phenylacetate, methyl 2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-2-phenylacetate, METHYL 2-{2-[(5-BUTYL-4-METHYL-1H-IMIDAZOL-2-YL)SULFANYL]ACETAMIDO}-2-PHENYLACETATE
| Molecular Formula | C19H25N3O3S |
|---|---|
| Molecular Weight | 375.16 g/mol |
| LogP | 3.18332 |
| Topological Polar Surface Area | 84.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 375.16165 |
| Heavy Atoms | 26 |
| Complexity | 730.8855 |
Chemical Identifiers
| CAS Number | 1009526-35-5 |
|---|---|
| SMILES | CCCCC1=C(NC(=N1)SCC(=O)NC(C2=CC=CC=C2)C(=O)OC)C |
Product Overview
A4101/0174857 (CAS 1009526-35-5), with molecular formula C19H25N3O3S and molecular weight 375.16 g/mol. IUPAC: methyl 2-[[2-[(4-butyl-5-methyl-1H-imidazol-2-yl)sulfanyl]acetyl]amino]-2-phenylacetate.
Chemical Property Profile of A4101/0174857
Property Insights of A4101/0174857
The XLogP value of 3.18332 indicates that A4101/0174857 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 A4101/0174857. Following Lipinski's Rule of Five, A4101/0174857 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 A4101/0174857?
The CAS number of A4101/0174857 is 1009526-35-5.
What is the molecular formula of A4101/0174857?
The molecular formula of A4101/0174857 is C19H25N3O3S.
What is the molecular weight of A4101/0174857?
The molecular weight of A4101/0174857 is 375.16 g/mol.
Where can I buy A4101/0174857?
You can request a quote for A4101/0174857 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A4101/0174857?
Yes, KEHONG BIO provides custom synthesis services for A4101/0174857 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.