N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester
TL;DR: N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester (CAS 136794-87-1) is a chemical compound with molecular formula C15H18INO2 and molecular weight 371.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (1R)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate
Also Known As: Nor-beta-cit, N-Nor-cit, NOR-EC-CIT, NOR-2-CIT, N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester
| Molecular Formula | C15H18INO2 |
|---|---|
| Molecular Weight | 371.04 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 371.03824 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 136794-87-1 |
|---|---|
| SMILES | COC(=O)C1[C@H]2CCC(N2)CC1C3=CC=C(C=C3)I |
| InChIKey | IBOZZWGMZPMXBO-WCFLAILDSA-N |
Product Overview
N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester (CAS 136794-87-1), with molecular formula C15H18INO2 and molecular weight 371.04 g/mol. IUPAC: methyl (1R)-3-(4-iodophenyl)-8-azabicyclo[3.2.1]octane-2-carboxylate.
Chemical Property Profile of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester
Property Insights of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester. With a topological polar surface area (TPSA) of 38.3 Ų, N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester has 1 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 N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester?
The CAS number of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester is 136794-87-1.
What is the molecular formula of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester?
The molecular formula of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester is C15H18INO2.
What is the molecular weight of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester?
The molecular weight of N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester is 371.04 g/mol.
Where can I buy N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester?
You can request a quote for N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester?
Yes, KEHONG BIO provides custom synthesis services for N-Nor-3-(4'-iodophenyl)tropane-2-carboxylic acid methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.