![methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate structure](/static/products/370/370840-97-4.png)
methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
TL;DR: methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate (CAS 370840-97-4) is a chemical compound with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[(2-thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Also Known As: Methyl 3-[(2-thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate, methyl 3-(2-thiomorpholinoacetamido)-1H-indole-2-carboxylate, methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
| Molecular Formula | C16H19N3O3S |
|---|---|
| Molecular Weight | 333.11 g/mol |
| LogP | 1.9418 |
| Topological Polar Surface Area | 74.43 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.11472 |
| Heavy Atoms | 23 |
| Complexity | 722.4288 |
Chemical Identifiers
| CAS Number | 370840-97-4 |
|---|---|
| SMILES | COC(=O)C1=C(C2=CC=CC=C2N1)NC(=O)CN3CCSCC3 |
Product Overview
methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate (CAS 370840-97-4), with molecular formula C16H19N3O3S and molecular weight 333.11 g/mol. IUPAC: methyl 3-[(2-thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
Property Insights of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate
The XLogP value of 1.9418 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate. The TPSA of 74.43 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate 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 methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate?
The CAS number of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate is 370840-97-4.
What is the molecular formula of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate?
The molecular formula of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate is C16H19N3O3S.
What is the molecular weight of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate?
The molecular weight of methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate is 333.11 g/mol.
Where can I buy methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate?
You can request a quote for methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(thiomorpholin-4-ylacetyl)amino]-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.