RefChem:281904
TL;DR: RefChem:281904 (CAS 78219-22-4) is a chemical compound with molecular formula C19H29ClN2O4 and molecular weight 384.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-(4-aminobenzoyl)oxy-1-(2-methylpropyl)piperidine-3-carboxylate;hydrochloride
Also Known As: 3-Carbethoxy-1-isobutyl-4-piperidyl p-aminobenzoate hydrochloride, 3-Ethoxycarbonyl-1-isobutyl-4-piperidyl p-aminobenzoate hydrochloride, Ethyl 4-hydroxy-1-isobutyl-3-piperidinecarboxylate p-aminobenzoate hydrochloride, p-Aminobenzoic acid 3-ethoxycarbonyl-1-isobutyl-4-piperidyl ester hydrochloride, 3-Piperidinecarboxylic acid, 4-hydroxy-1-isobutyl-, ethyl ester, p-aminobenzoate, hydrochloride
| Molecular Formula | C19H29ClN2O4 |
|---|---|
| Molecular Weight | 384.18 g/mol |
| LogP | 2.757 |
| Topological Polar Surface Area | 81.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 384.18158 |
| Heavy Atoms | 26 |
| Complexity | 591.70685 |
Chemical Identifiers
| CAS Number | 78219-22-4 |
|---|---|
| SMILES | CCOC(=O)C1CN(CCC1OC(=O)C2=CC=C(C=C2)N)CC(C)C.Cl |
Product Overview
RefChem:281904 (CAS 78219-22-4), with molecular formula C19H29ClN2O4 and molecular weight 384.18 g/mol. IUPAC: ethyl 4-(4-aminobenzoyl)oxy-1-(2-methylpropyl)piperidine-3-carboxylate;hydrochloride.
Chemical Property Profile of RefChem:281904
Property Insights of RefChem:281904
The XLogP value of 2.757 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:281904. The TPSA of 81.86 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:281904. Following Lipinski's Rule of Five, RefChem:281904 has 1 hydrogen bond donor(s) and 6 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 RefChem:281904?
The CAS number of RefChem:281904 is 78219-22-4.
What is the molecular formula of RefChem:281904?
The molecular formula of RefChem:281904 is C19H29ClN2O4.
What is the molecular weight of RefChem:281904?
The molecular weight of RefChem:281904 is 384.18 g/mol.
Where can I buy RefChem:281904?
You can request a quote for RefChem:281904 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:281904?
Yes, KEHONG BIO provides custom synthesis services for RefChem:281904 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.