RefChem:327883
TL;DR: RefChem:327883 (CAS 69815-33-4) is a chemical compound with molecular formula C21H36N2O5 and molecular weight 396.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-aminobenzoyl)oxypropan-2-yl-(2,6-dimethylheptan-4-yl)azanium;2-hydroxyacetate
Also Known As: Benzoic acid, p-amino-, 2-((1-isobutyl-3-methylbutyl)amino)propyl ester, glycolate, 1-(4-(2,6-Dimethylheptyl)amino)-2-propanol p-aminobenzoate glycolate, p-Aminobenzoic acid 2-((1-isobutyl-3-methylbutyl)amino)propyl ester glycolate, 1-(4-aminobenzoyl)oxypropan-2-yl-(2,6-dimethylheptan-4-yl)azanium; 2-hydroxyacetate, 1-(4-aminobenzoyl)oxypropan-2-yl-(2,6-dimethylheptan-4-yl)azanium;2-hydroxyacetate
| Molecular Formula | C21H36N2O5 |
|---|---|
| Molecular Weight | 396.26 g/mol |
| LogP | 0.57 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 396.26242 |
| Heavy Atoms | 28 |
| Complexity | 361.0 |
Chemical Identifiers
| CAS Number | 69815-33-4 |
|---|---|
| SMILES | CC(C)CC(CC(C)C)[NH2+]C(C)COC(=O)C1=CC=C(C=C1)N.C(C(=O)[O-])O |
| InChIKey | JHCJSHKRCXOAIA-UHFFFAOYSA-N |
Product Overview
RefChem:327883 (CAS 69815-33-4), with molecular formula C21H36N2O5 and molecular weight 396.26 g/mol. IUPAC: 1-(4-aminobenzoyl)oxypropan-2-yl-(2,6-dimethylheptan-4-yl)azanium;2-hydroxyacetate.
Chemical Property Profile of RefChem:327883
Property Insights of RefChem:327883
The XLogP value of 0.57 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:327883. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:327883. Following Lipinski's Rule of Five, RefChem:327883 has 3 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:327883?
The CAS number of RefChem:327883 is 69815-33-4.
What is the molecular formula of RefChem:327883?
The molecular formula of RefChem:327883 is C21H36N2O5.
What is the molecular weight of RefChem:327883?
The molecular weight of RefChem:327883 is 396.26 g/mol.
Where can I buy RefChem:327883?
You can request a quote for RefChem:327883 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:327883?
Yes, KEHONG BIO provides custom synthesis services for RefChem:327883 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.