Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate
TL;DR: Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate (CAS 401565-95-5) is a chemical compound with molecular formula C16H23ClN2O2 and molecular weight 310.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tert-butyl 4-(4-chloroanilino)piperidine-1-carboxylate
Also Known As: tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate, tert-butyl 4-(4-chloroanilino)piperidine-1-carboxylate, tert-butyl 4-(4-chloroanilino)tetrahydro-1(2H)-pyridinecarboxylate, tert-butyl 4-(4-chlorophenylamino)-piperidine-1-carboxylate, tert-butyl 4-[(4-chlorophenyl)amino]piperidine-1-carboxylate
| Molecular Formula | C16H23ClN2O2 |
|---|---|
| Molecular Weight | 310.14 g/mol |
| LogP | 4.1514 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 310.1448 |
| Heavy Atoms | 21 |
| Complexity | 474.0455 |
Chemical Identifiers
| CAS Number | 401565-95-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N1CCC(CC1)NC2=CC=C(C=C2)Cl |
Product Overview
Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate (CAS 401565-95-5), with molecular formula C16H23ClN2O2 and molecular weight 310.14 g/mol. IUPAC: tert-butyl 4-(4-chloroanilino)piperidine-1-carboxylate.
Chemical Property Profile of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate
Property Insights of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate
The XLogP value of 4.1514 indicates that Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.57 Ų, Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate 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 Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate?
The CAS number of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate is 401565-95-5.
What is the molecular formula of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate?
The molecular formula of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate is C16H23ClN2O2.
What is the molecular weight of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate?
The molecular weight of Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate is 310.14 g/mol.
Where can I buy Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate?
You can request a quote for Tert-butyl 4-(4-chlorophenylamino)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-chlorophenylamino)piperidine-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for Tert-butyl 4-(4-chlorophenylamino)piperidine-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.