Gd-Dtpa-hpdp
TL;DR: Gd-Dtpa-hpdp (CAS 133019-01-9) is a chemical compound with molecular formula C17H29GdN4O16P2 and molecular weight 765.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[(3-hydroxy-3,3-diphosphonatopropyl)amino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+);hydron
Also Known As: Gd-Dtpa-hpdp, 2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[(3-hydroxy-3,3-diphosphonatopropyl)amino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+);hydron, 2-[2-[bis(2-oxido-2-oxoethyl)amino]ethyl-[2-[[2-[(3-hydroxy-3,3-diphosphonatopropyl)amino]-2-oxoethyl]-(2-oxido-2-oxoethyl)amino]ethyl]amino]acetate; gadolinium(3+); hydron
| Molecular Formula | C17H29GdN4O16P2 |
|---|---|
| Molecular Weight | 765.03 g/mol |
| LogP | -11.5657 |
| Topological Polar Surface Area | 345.95 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 21 |
| Exact Mass | 765.0295 |
| Heavy Atoms | 40 |
| Complexity | 973.122 |
Chemical Identifiers
| CAS Number | 133019-01-9 |
|---|---|
| SMILES | [H+].[H+].[H+].[H+].[H+].C(CNC(=O)CN(CCN(CCN(CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])CC(=O)[O-])C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Gd+3] |
Product Overview
Gd-Dtpa-hpdp (CAS 133019-01-9), with molecular formula C17H29GdN4O16P2 and molecular weight 765.03 g/mol. IUPAC: 2-[2-[bis(carboxylatomethyl)amino]ethyl-[2-[carboxylatomethyl-[2-[(3-hydroxy-3,3-diphosphonatopropyl)amino]-2-oxoethyl]amino]ethyl]amino]acetate;gadolinium(3+);hydron.
Chemical Property Profile of Gd-Dtpa-hpdp
Property Insights of Gd-Dtpa-hpdp
The XLogP value of -11.5657 indicates that Gd-Dtpa-hpdp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.95 Ų indicates high polarity, suggesting Gd-Dtpa-hpdp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gd-Dtpa-hpdp has 2 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gd-Dtpa-hpdp?
The CAS number of Gd-Dtpa-hpdp is 133019-01-9.
What is the molecular formula of Gd-Dtpa-hpdp?
The molecular formula of Gd-Dtpa-hpdp is C17H29GdN4O16P2.
What is the molecular weight of Gd-Dtpa-hpdp?
The molecular weight of Gd-Dtpa-hpdp is 765.03 g/mol.
Where can I buy Gd-Dtpa-hpdp?
You can request a quote for Gd-Dtpa-hpdp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gd-Dtpa-hpdp?
Yes, KEHONG BIO provides custom synthesis services for Gd-Dtpa-hpdp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.