Caldopentamine
TL;DR: Caldopentamine (CAS 13274-42-5) is a chemical compound with molecular formula C12H31N5 and molecular weight 245.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[3-[3-(3-aminopropylamino)propylamino]propyl]propane-1,3-diamine
Also Known As: Caldopentamine, Tetrapropylenepentamine, Tetratrimethylenepentamine, 1,17-DATAH, 1,15-diamino-4,8,12-triazapentadecane
| Molecular Formula | C12H31N5 |
|---|---|
| Molecular Weight | 245.26 g/mol |
| LogP | -1.5 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 14 |
| Exact Mass | 245.25795 |
| Heavy Atoms | 17 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 13274-42-5 |
|---|---|
| SMILES | C(CN)CNCCCNCCCNCCCN |
| InChIKey | BELZJFWUNQWBES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Caldopentamine (CAS 13274-42-5), with molecular formula C12H31N5 and molecular weight 245.26 g/mol. IUPAC: N'-[3-[3-(3-aminopropylamino)propylamino]propyl]propane-1,3-diamine.
Chemical Property Profile of Caldopentamine
Property Insights of Caldopentamine
The XLogP value of -1.5 indicates that Caldopentamine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Caldopentamine. Following Lipinski's Rule of Five, Caldopentamine has 5 hydrogen bond donor(s) and 5 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 Caldopentamine?
The CAS number of Caldopentamine is 13274-42-5.
What is the molecular formula of Caldopentamine?
The molecular formula of Caldopentamine is C12H31N5.
What is the molecular weight of Caldopentamine?
The molecular weight of Caldopentamine is 245.26 g/mol.
Where can I buy Caldopentamine?
You can request a quote for Caldopentamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caldopentamine?
Yes, KEHONG BIO provides custom synthesis services for Caldopentamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.