methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride
TL;DR: methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride (CAS 146074-43-3) is a chemical compound with molecular formula C11H14ClNO2 and molecular weight 227.0713 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride
Also Known As: (s)-methyl 1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride, H-Tic-Ome HCl, 9221AH, Methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate Hydrochloride, methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate;hydrochloride
Technical Specifications
| Molecular Formula | C11H14ClNO2 |
| Molecular Weight | 227.0713 g/mol |
| XLogP | 1.2957 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 227.0713 Da |
| Heavy Atoms | 15 |
| Complexity | 217.0 |
| SMILES | COC(=O)[C@@H]1CC2=CC=CC=C2CN1.Cl |
| InChIKey | BUXCBOUGBHWQBE-PPHPATTJSA-N |
Chemical Property Profile of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride
Property Insights of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride
The XLogP value of 1.2957 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride. With a topological polar surface area (TPSA) of 38.3 Ų, methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride?
The CAS number of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride is 146074-43-3.
What is the molecular formula of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride?
The molecular formula of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride is C11H14ClNO2.
What is the molecular weight of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride?
The molecular weight of methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride is 227.0713 g/mol.
Where can I buy methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride?
You can request a quote for methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride?
Yes, CoreyChem provides custom synthesis services for methyl (3S)-1,2,3,4-tetrahydroisoquinoline-3-carboxylate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.