A1183/0054743
TL;DR: A1183/0054743 (CAS 313380-01-7) is a chemical compound with molecular formula C16H14N6O2S5 and molecular weight 481.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide
Also Known As: A1183/0054743, 2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide, 2,2'-((4-cyanoisothiazole-3,5-diyl)bis(sulfanediyl))bis(N-(4-methylthiazol-2-yl)acetamide), 2,2'-[(4-cyano-1,2-thiazole-3,5-diyl)disulfanediyl]bis[N-(4-methyl-1,3-thiazol-2-yl)acetamide], 2-(4-cyano-3-{[N-(4-methyl(1,3-thiazol-2-yl))carbamoyl]methylthio}isothiazol-5 -ylthio)-N-(4-methyl(1,3-thiazol-2-yl))acetamide
| Molecular Formula | C16H14N6O2S5 |
|---|---|
| Molecular Weight | 481.98 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 256.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 8 |
| Exact Mass | 481.97818 |
| Heavy Atoms | 29 |
| Complexity | 649.0 |
Chemical Identifiers
| CAS Number | 313380-01-7 |
|---|---|
| SMILES | CC1=CSC(=N1)NC(=O)CSC2=C(C(=NS2)SCC(=O)NC3=NC(=CS3)C)C#N |
| InChIKey | LHPLNHDJOIBQPV-UHFFFAOYSA-N |
Product Overview
A1183/0054743 (CAS 313380-01-7), with molecular formula C16H14N6O2S5 and molecular weight 481.98 g/mol. IUPAC: 2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide.
Chemical Property Profile of A1183/0054743
Property Insights of A1183/0054743
The XLogP value of 3.7 indicates that A1183/0054743 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 256.0 Ų indicates high polarity, suggesting A1183/0054743 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, A1183/0054743 has 2 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A1183/0054743?
The CAS number of A1183/0054743 is 313380-01-7.
What is the molecular formula of A1183/0054743?
The molecular formula of A1183/0054743 is C16H14N6O2S5.
What is the molecular weight of A1183/0054743?
The molecular weight of A1183/0054743 is 481.98 g/mol.
Where can I buy A1183/0054743?
You can request a quote for A1183/0054743 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A1183/0054743?
Yes, KEHONG BIO provides custom synthesis services for A1183/0054743 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.