tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate
TL;DR: tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate (CAS 1197778-63-4) is a chemical compound with molecular formula C19H27BrN2O3 and molecular weight 410.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-[(4-bromophenyl)methyl-methylcarbamoyl]piperidine-1-carboxylate
Also Known As: tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate, tert-butyl 4-[(4-bromophenyl)methyl-methylcarbamoyl]piperidine-1-carboxylate
| Molecular Formula | C19H27BrN2O3 |
|---|---|
| Molecular Weight | 410.12 g/mol |
| LogP | 4.0546 |
| Topological Polar Surface Area | 49.85 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 410.1205 |
| Heavy Atoms | 25 |
| Complexity | 602.0904 |
Chemical Identifiers
| CAS Number | 1197778-63-4 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N(C)CC2=CC=C(C=C2)Br |
Product Overview
tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate (CAS 1197778-63-4), with molecular formula C19H27BrN2O3 and molecular weight 410.12 g/mol. IUPAC: tert-butyl 4-[(4-bromophenyl)methyl-methylcarbamoyl]piperidine-1-carboxylate.
Chemical Property Profile of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate
Property Insights of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate
The XLogP value of 4.0546 indicates that tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.85 Ų, tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-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 tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate?
The CAS number of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate is 1197778-63-4.
What is the molecular formula of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate?
The molecular formula of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate is C19H27BrN2O3.
What is the molecular weight of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate?
The molecular weight of tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate is 410.12 g/mol.
Where can I buy tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate?
You can request a quote for tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl 4-((4-bromobenzyl)(methyl)carbamoyl)piperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.