RefChem:327877
TL;DR: RefChem:327877 (CAS 69780-91-2) is a chemical compound with molecular formula C17H29ClN2O2 and molecular weight 328.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-aminobenzoyl)oxypropyl-heptan-4-ylazanium chloride
Also Known As: Benzoic acid, p-amino-, 1-methyl-2-((1-propylbutyl)amino)ethyl ester, hydrochloride, 2-(4-aminobenzoyl)oxypropyl-heptan-4-ylazanium chloride, p-Aminobenzoic acid 1-methyl-2-((1-propylbutyl)amino)ethyl ester hydrochloride, RefChem:327877
| Molecular Formula | C17H29ClN2O2 |
|---|---|
| Molecular Weight | 328.19 g/mol |
| LogP | -0.65 |
| Topological Polar Surface Area | 68.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 10 |
| Exact Mass | 328.19174 |
| Heavy Atoms | 22 |
| Complexity | 283.0 |
Chemical Identifiers
| CAS Number | 69780-91-2 |
|---|---|
| SMILES | CCCC(CCC)[NH2+]CC(C)OC(=O)C1=CC=C(C=C1)N.[Cl-] |
| InChIKey | KFOGDMHRABAIMS-UHFFFAOYSA-N |
Product Overview
RefChem:327877 (CAS 69780-91-2), with molecular formula C17H29ClN2O2 and molecular weight 328.19 g/mol. IUPAC: 2-(4-aminobenzoyl)oxypropyl-heptan-4-ylazanium chloride.
Chemical Property Profile of RefChem:327877
Property Insights of RefChem:327877
The XLogP value of -0.65 indicates that RefChem:327877 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 68.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:327877. Following Lipinski's Rule of Five, RefChem:327877 has 2 hydrogen bond donor(s) and 4 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:327877?
The CAS number of RefChem:327877 is 69780-91-2.
What is the molecular formula of RefChem:327877?
The molecular formula of RefChem:327877 is C17H29ClN2O2.
What is the molecular weight of RefChem:327877?
The molecular weight of RefChem:327877 is 328.19 g/mol.
Where can I buy RefChem:327877?
You can request a quote for RefChem:327877 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327877?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327877 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.