Dapabutan
TL;DR: Dapabutan (CAS 6582-31-6) is a chemical compound with molecular formula C19H40N2O2 and molecular weight 328.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[3-(dodecylamino)propylamino]butanoic acid
Also Known As: Dapabutan, Dapabutan [INN], Dapabutano, PHOSPHORUSTRIFLUORIDE, DAPABUTAN [WHO-DD]
| Molecular Formula | C19H40N2O2 |
|---|---|
| Molecular Weight | 328.31 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 18 |
| Exact Mass | 328.309 |
| Heavy Atoms | 23 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 6582-31-6 |
|---|---|
| SMILES | CCCCCCCCCCCCNCCCNC(C)CC(=O)O |
| InChIKey | KRGUCURBMCFAOW-UHFFFAOYSA-N |
Product Overview
Dapabutan (CAS 6582-31-6), with molecular formula C19H40N2O2 and molecular weight 328.31 g/mol. IUPAC: 3-[3-(dodecylamino)propylamino]butanoic acid.
Chemical Property Profile of Dapabutan
Property Insights of Dapabutan
The XLogP value of 3.0 indicates that Dapabutan is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Dapabutan. Following Lipinski's Rule of Five, Dapabutan has 3 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 Dapabutan?
The CAS number of Dapabutan is 6582-31-6.
What is the molecular formula of Dapabutan?
The molecular formula of Dapabutan is C19H40N2O2.
What is the molecular weight of Dapabutan?
The molecular weight of Dapabutan is 328.31 g/mol.
Where can I buy Dapabutan?
You can request a quote for Dapabutan directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dapabutan?
Yes, KEHONG BIO provides custom synthesis services for Dapabutan and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.