1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide
TL;DR: 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide (CAS 7012-77-3) is a chemical compound with molecular formula C15H21BrClNO2 and molecular weight 361.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(4-chlorophenyl)-2-piperidin-1-ylpropanoate;hydrobromide
Also Known As: alpha-(p-Chlorobenzyl)-1-piperidineacetic acid methyl ester hydrobromide, 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide, methyl 3-(4-chlorophenyl)-2-piperidin-1-ylpropanoate hydrobromide, Methyl 3-(4-chlorophenyl)-2-(piperidin-1-yl)propanoate--hydrogen bromide (1/1), RefChem:1056735
| Molecular Formula | C15H21BrClNO2 |
|---|---|
| Molecular Weight | 361.04 g/mol |
| LogP | 3.4879 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 361.04443 |
| Heavy Atoms | 20 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 7012-77-3 |
|---|---|
| SMILES | COC(=O)C(CC1=CC=C(C=C1)Cl)N2CCCCC2.Br |
| InChIKey | SLDBERCNSBTJDQ-UHFFFAOYSA-N |
Product Overview
1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide (CAS 7012-77-3), with molecular formula C15H21BrClNO2 and molecular weight 361.04 g/mol. IUPAC: methyl 3-(4-chlorophenyl)-2-piperidin-1-ylpropanoate;hydrobromide.
Chemical Property Profile of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide
Property Insights of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide
The XLogP value of 3.4879 indicates that 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide 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 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide?
The CAS number of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide is 7012-77-3.
What is the molecular formula of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide?
The molecular formula of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide is C15H21BrClNO2.
What is the molecular weight of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide?
The molecular weight of 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide is 361.04 g/mol.
Where can I buy 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide?
You can request a quote for 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 1-Piperidineacetic acid, alpha-(p-chlorobenzyl)-, methyl ester, hydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.