Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate
TL;DR: Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate (CAS 349442-26-8) is a chemical compound with molecular formula C14H16INO3 and molecular weight 373.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate
Also Known As: methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate, A1-54687, methyl 1-[(3-iodophenyl)carbonyl]piperidine-4-carboxylate
| Molecular Formula | C14H16INO3 |
|---|---|
| Molecular Weight | 373.02 g/mol |
| LogP | 2.3164 |
| Topological Polar Surface Area | 46.61 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 373.0175 |
| Heavy Atoms | 19 |
| Complexity | 481.33435 |
Chemical Identifiers
| CAS Number | 349442-26-8 |
|---|---|
| SMILES | COC(=O)C1CCN(CC1)C(=O)C2=CC(=CC=C2)I |
Product Overview
Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate (CAS 349442-26-8), with molecular formula C14H16INO3 and molecular weight 373.02 g/mol. IUPAC: methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate.
Chemical Property Profile of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate
Property Insights of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate
The XLogP value of 2.3164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate. With a topological polar surface area (TPSA) of 46.61 Ų, Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate has 0 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 1-(3-iodobenzoyl)piperidine-4-carboxylate?
The CAS number of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate is 349442-26-8.
What is the molecular formula of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate?
The molecular formula of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate is C14H16INO3.
What is the molecular weight of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate?
The molecular weight of Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate is 373.02 g/mol.
Where can I buy Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate?
You can request a quote for Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 1-(3-iodobenzoyl)piperidine-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.