![5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid structure](/static/products/100/1005188-44-2.png)
5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid
TL;DR: 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid (CAS 1005188-44-2) is a chemical compound with molecular formula C20H19NO3 and molecular weight 321.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid
Also Known As: 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid, 5,13-dimethyl-7-oxo-7,11b,12,13-tetrahydro-5H-benzo[5,6]azepino[2,1-a]isoindole-8-carboxylic acid
| Molecular Formula | C20H19NO3 |
|---|---|
| Molecular Weight | 321.14 g/mol |
| LogP | 4.1501 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 321.1365 |
| Heavy Atoms | 24 |
| Complexity | 857.7125 |
Chemical Identifiers
| CAS Number | 1005188-44-2 |
|---|---|
| SMILES | CC1CC2C3=C(C(=CC=C3)C(=O)O)C(=O)N2C(C4=CC=CC=C14)C |
Product Overview
5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid (CAS 1005188-44-2), with molecular formula C20H19NO3 and molecular weight 321.14 g/mol. IUPAC: 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid.
Chemical Property Profile of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid
Property Insights of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid
The XLogP value of 4.1501 indicates that 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.61 Ų, 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid has 1 hydrogen bond donor(s) and 2 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 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid?
The CAS number of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid is 1005188-44-2.
What is the molecular formula of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid?
The molecular formula of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid is C20H19NO3.
What is the molecular weight of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid?
The molecular weight of 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid is 321.14 g/mol.
Where can I buy 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid?
You can request a quote for 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 5,13-dimethyl-7-oxo-5,11b,12,13-tetrahydroisoindolo[2,1-b][2]benzazepine-8-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.