Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate
TL;DR: Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate (CAS 69781-49-3) is a chemical compound with molecular formula C22H36N2O6 and molecular weight 424.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-aminobenzoyl)oxypropyl-dibutylazanium;4-hydroxy-4-oxobutanoate
Also Known As: Aminobenzoyldibutylaminopropanol succinate, p-Aminobenzoic acid 3-(dibutylamino)propyl ester succinate, BENZOIC ACID, p-AMINO-, 3-(DIBUTYLAMINO)PROPYL ESTER, SUCCINATE, 3-(4-aminobenzoyl)oxypropyl-dibutylazanium; 4-hydroxy-4-oxobutanoate, N-{3-[(4-Aminobenzoyl)oxy]propyl}-N-butylbutan-1-aminium 3-carboxypropanoate
| Molecular Formula | C22H36N2O6 |
|---|---|
| Molecular Weight | 424.26 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 14 |
| Exact Mass | 424.25732 |
| Heavy Atoms | 30 |
| Complexity | 382.0 |
Chemical Identifiers
| CAS Number | 69781-49-3 |
|---|---|
| SMILES | CCCC[NH+](CCCC)CCCOC(=O)C1=CC=C(C=C1)N.C(CC(=O)[O-])C(=O)O |
| InChIKey | SAPRVOBGXHQOCS-UHFFFAOYSA-N |
Product Overview
Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate (CAS 69781-49-3), with molecular formula C22H36N2O6 and molecular weight 424.26 g/mol. IUPAC: 3-(4-aminobenzoyl)oxypropyl-dibutylazanium;4-hydroxy-4-oxobutanoate.
Chemical Property Profile of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate
Property Insights of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate. Following Lipinski's Rule of Five, Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate has 3 hydrogen bond donor(s) and 7 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 Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate?
The CAS number of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate is 69781-49-3.
What is the molecular formula of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate?
The molecular formula of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate is C22H36N2O6.
What is the molecular weight of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate?
The molecular weight of Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate is 424.26 g/mol.
Where can I buy Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate?
You can request a quote for Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, p-amino-, 3-(dibutylamino)propyl ester, succinate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.