9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester
TL;DR: 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester (CAS 119377-12-7) is a chemical compound with molecular formula C20H17N3O2 and molecular weight 331.13208 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propyl 1-pyridin-3-yl-9H-pyrido[3,4-b]indole-3-carboxylate
Also Known As: 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester, Propyl 1-(3-pyridinyl)-9H-pyrido(3,4-b)indole-3-carboxylate, PROPYL 1-(PYRIDIN-3-YL)-9H-PYRIDO[3,4-B]INDOLE-3-CARBOXYLATE, 1-(3-Pyridyl)-beta-carboline-3-carboxylic acid propyl ester, propyl 1-pyridin-3-yl-9H-pyrido[3,4-b]indole-3-carboxylate
Technical Specifications
| Molecular Formula | C20H17N3O2 |
| Molecular Weight | 331.13208 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 331.13208 Da |
| Heavy Atoms | 25 |
| Complexity | 472.0 |
| SMILES | CCCOC(=O)C1=NC(=C2C(=C1)C3=CC=CC=C3N2)C4=CN=CC=C4 |
| InChIKey | XTWGGNCKUJILMZ-UHFFFAOYSA-N |
Chemical Property Profile of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester
Property Insights of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester
The XLogP value of 4.0 indicates that 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester. Following Lipinski's Rule of Five, 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester?
The CAS number of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester is 119377-12-7.
What is the molecular formula of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester?
The molecular formula of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester is C20H17N3O2.
What is the molecular weight of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester?
The molecular weight of 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester is 331.13208 g/mol.
Where can I buy 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester?
You can request a quote for 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester?
Yes, CoreyChem provides custom synthesis services for 9H-Pyrido(3,4-b)indole-3-carboxylic acid, 1-(3-pyridinyl)-, propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.