![methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate structure](/static/products/587/587006-06-2.png)
methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate
TL;DR: methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate (CAS 587006-06-2) is a chemical compound with molecular formula C16H21N3O4 and molecular weight 319.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[3-(dimethylamino)propanoylamino]-6-methoxy-1H-indole-2-carboxylate
Also Known As: methyl 3-(3-(dimethylamino)propanamido)-6-methoxy-1H-indole-2-carboxylate, Methyl 3-(3-dimethylaminopropanoylamino)-6-methoxy-1H-indole-2-carboxylate, methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate, methyl 3-[3-(dimethylamino)propanoylamino]-6-methoxy-1H-indole-2-carboxylate
| Molecular Formula | C16H21N3O4 |
|---|---|
| Molecular Weight | 319.15 g/mol |
| LogP | 1.8533 |
| Topological Polar Surface Area | 83.66 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.1532 |
| Heavy Atoms | 23 |
| Complexity | 721.4288 |
Chemical Identifiers
| CAS Number | 587006-06-2 |
|---|---|
| SMILES | CN(C)CCC(=O)NC1=C(NC2=C1C=CC(=C2)OC)C(=O)OC |
Product Overview
methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate (CAS 587006-06-2), with molecular formula C16H21N3O4 and molecular weight 319.15 g/mol. IUPAC: methyl 3-[3-(dimethylamino)propanoylamino]-6-methoxy-1H-indole-2-carboxylate.
Chemical Property Profile of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate
Property Insights of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate
The XLogP value of 1.8533 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate. The TPSA of 83.66 Ų falls within the moderate polarity range, balancing permeability and solubility for methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate. Following Lipinski's Rule of Five, methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-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-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The CAS number of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate is 587006-06-2.
What is the molecular formula of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The molecular formula of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate is C16H21N3O4.
What is the molecular weight of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate?
The molecular weight of methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate is 319.15 g/mol.
Where can I buy methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate?
You can request a quote for methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-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-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for methyl 3-[(N,N-dimethyl-beta-alanyl)amino]-6-methoxy-1H-indole-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.