Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate
TL;DR: Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate (CAS 63430-79-5) is a chemical compound with molecular formula C11H13NO2 and molecular weight 191.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate
Also Known As: methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate, (S)-1,2,3,4-Tetrahydroquinoline-2-carboxylic acid methyl ester, (S)-methyl 1,2,3,4-tetrahydroquinoline-2-carboxylate, (S)-1,2,3,4-TETRAHYDRO-QUINOLINE-2-CARBOXYLIC ACID METHYL ESTER, H547
| Molecular Formula | C11H13NO2 |
|---|---|
| Molecular Weight | 191.09 g/mol |
| LogP | 1.5863 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.09464 |
| Heavy Atoms | 14 |
| Complexity | 348.8957 |
Chemical Identifiers
| CAS Number | 63430-79-5 |
|---|---|
| SMILES | COC(=O)[C@@H]1CCC2=CC=CC=C2N1 |
Product Overview
Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate (CAS 63430-79-5), with molecular formula C11H13NO2 and molecular weight 191.09 g/mol. IUPAC: methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate.
Chemical Property Profile of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate
Property Insights of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate
The XLogP value of 1.5863 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate. With a topological polar surface area (TPSA) of 38.33 Ų, Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate has 1 hydrogen bond donor(s) and 3 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 (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate?
The CAS number of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate is 63430-79-5.
What is the molecular formula of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate?
The molecular formula of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate is C11H13NO2.
What is the molecular weight of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate?
The molecular weight of Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate is 191.09 g/mol.
Where can I buy Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate?
You can request a quote for Methyl (2S)-1,2,3,4-tetrahydroquinoline-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 (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl (2S)-1,2,3,4-tetrahydroquinoline-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.