(5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate
TL;DR: (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate (CAS 1036127-93-1) is a chemical compound with molecular formula C17H12N2O3S and molecular weight 324.05685 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1H-indole-2-carboxylate
Also Known As: (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate, [5-(THIOPHEN-2-YL)-1,2-OXAZOL-3-YL]METHYL 1H-INDOLE-2-CARBOXYLATE, F2496-2950, (5-thiophen-2-yl-1,2-oxazol-3-yl)methyl 1H-indole-2-carboxylate
Technical Specifications
| Molecular Formula | C17H12N2O3S |
| Molecular Weight | 324.05685 g/mol |
| XLogP | 3.6 |
| Topological Polar Surface Area (TPSA) | 96.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.05685 Da |
| Heavy Atoms | 23 |
| Complexity | 436.0 |
| SMILES | C1=CC=C2C(=C1)C=C(N2)C(=O)OCC3=NOC(=C3)C4=CC=CS4 |
| InChIKey | CHXANWXYFSUZRK-UHFFFAOYSA-N |
Chemical Property Profile of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate
Property Insights of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate
The XLogP value of 3.6 indicates that (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate. Following Lipinski's Rule of Five, (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate?
The CAS number of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate is 1036127-93-1.
What is the molecular formula of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate?
The molecular formula of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate is C17H12N2O3S.
What is the molecular weight of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate?
The molecular weight of (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate is 324.05685 g/mol.
Where can I buy (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate?
You can request a quote for (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate?
Yes, CoreyChem provides custom synthesis services for (5-(thiophen-2-yl)isoxazol-3-yl)methyl 1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.