1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-
TL;DR: 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- (CAS 54193-05-4) is a chemical compound with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,3S)-1,2-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid
Also Known As: 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-, (1S-cis)-2,3,4,9-Tetrahydro-1,2-dimethyl-1H-pyrido(3,4-b)indole-3-carboxylic acid, (1S,3S)-1,2-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid, (1S,3S)-1,2-Dimethyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
| Molecular Formula | C14H16N2O2 |
|---|---|
| Molecular Weight | 244.12 g/mol |
| LogP | -0.3 |
| Topological Polar Surface Area | 56.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 244.12119 |
| Heavy Atoms | 18 |
| Complexity | 347.0 |
Chemical Identifiers
| CAS Number | 54193-05-4 |
|---|---|
| SMILES | C[C@H]1C2=C(C[C@H](N1C)C(=O)O)C3=CC=CC=C3N2 |
| InChIKey | TWPZAUPPRSQWBA-UFBFGSQYSA-N |
Product Overview
1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- (CAS 54193-05-4), with molecular formula C14H16N2O2 and molecular weight 244.12 g/mol. IUPAC: (1S,3S)-1,2-dimethyl-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carboxylic acid.
Chemical Property Profile of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-
Property Insights of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-
The XLogP value of -0.3 indicates that 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 56.3 Ų, 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- 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
Frequently Asked Questions
What is the CAS number of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-?
The CAS number of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- is 54193-05-4.
What is the molecular formula of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-?
The molecular formula of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- is C14H16N2O2.
What is the molecular weight of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-?
The molecular weight of 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- is 244.12 g/mol.
Where can I buy 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-?
You can request a quote for 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Pyrido(3,4-b)indole-3-carboxylic acid, 2,3,4,9-tetrahydro-1,2-dimethyl-, (1S-cis)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.