Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride
TL;DR: Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride (CAS 101372-78-5) is a chemical compound with molecular formula C14H17ClN2O2 and molecular weight 280.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate;hydrochloride
Also Known As: Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride, 1H-Pyrido(3,4-b)indole-1-carboxylic acid, 2,3,4,9-tetrahydro-1-methyl-, methyl ester, monohydrochloride, methyl 1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate hydrochloride, Methyl 1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-1-carboxylate--hydrogen chloride (1/1)
| Molecular Formula | C14H17ClN2O2 |
|---|---|
| Molecular Weight | 280.10 g/mol |
| LogP | 2.1236 |
| Topological Polar Surface Area | 54.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.09787 |
| Heavy Atoms | 19 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 101372-78-5 |
|---|---|
| SMILES | CC1(C2=C(CCN1)C3=CC=CC=C3N2)C(=O)OC.Cl |
| InChIKey | PAPZMMZVGDNJTI-UHFFFAOYSA-N |
Product Overview
Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride (CAS 101372-78-5), with molecular formula C14H17ClN2O2 and molecular weight 280.10 g/mol. IUPAC: methyl 1-methyl-2,3,4,9-tetrahydropyrido[3,4-b]indole-1-carboxylate;hydrochloride.
Chemical Property Profile of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride
Property Insights of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride
The XLogP value of 2.1236 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride. With a topological polar surface area (TPSA) of 54.1 Ų, Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride has 3 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 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride?
The CAS number of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride is 101372-78-5.
What is the molecular formula of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride?
The molecular formula of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride is C14H17ClN2O2.
What is the molecular weight of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride?
The molecular weight of Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride is 280.10 g/mol.
Where can I buy Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride?
You can request a quote for Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3,4,9-tetrahydro-1-methyl-1H-pyrido(3,4-b)indole-1-carboxylate monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.