Disodium cycloheptylaminomethylenediphosphonate
TL;DR: Disodium cycloheptylaminomethylenediphosphonate (CAS 138330-18-4) is a chemical compound with molecular formula C9H18Na2O6P2 and molecular weight 330.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
disodium;[2-cycloheptyl-1-[hydroxy(oxido)phosphoryl]ethyl]-hydroxyphosphinate
Also Known As: Cimadronate, Incadronate, YM 175, Disodium cycloheptylaminomethylenediphosphonate, Phosphonic acid, ((cycloheptylamino)methylene)bis-, disodium salt
| Molecular Formula | C9H18Na2O6P2 |
|---|---|
| Molecular Weight | 330.04 g/mol |
| LogP | -5.23 |
| Topological Polar Surface Area | 121.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 330.0374 |
| Heavy Atoms | 19 |
| Complexity | 298.0 |
Chemical Identifiers
| CAS Number | 138330-18-4 |
|---|---|
| SMILES | C1CCCC(CC1)CC(P(=O)(O)[O-])P(=O)(O)[O-].[Na+].[Na+] |
| InChIKey | RLIRIVMEKVNVQX-UHFFFAOYSA-L |
Product Overview
Disodium cycloheptylaminomethylenediphosphonate (CAS 138330-18-4), with molecular formula C9H18Na2O6P2 and molecular weight 330.04 g/mol. IUPAC: disodium;[2-cycloheptyl-1-[hydroxy(oxido)phosphoryl]ethyl]-hydroxyphosphinate.
Chemical Property Profile of Disodium cycloheptylaminomethylenediphosphonate
Property Insights of Disodium cycloheptylaminomethylenediphosphonate
The XLogP value of -5.23 indicates that Disodium cycloheptylaminomethylenediphosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 121.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Disodium cycloheptylaminomethylenediphosphonate. Following Lipinski's Rule of Five, Disodium cycloheptylaminomethylenediphosphonate has 2 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 Disodium cycloheptylaminomethylenediphosphonate?
The CAS number of Disodium cycloheptylaminomethylenediphosphonate is 138330-18-4.
What is the molecular formula of Disodium cycloheptylaminomethylenediphosphonate?
The molecular formula of Disodium cycloheptylaminomethylenediphosphonate is C9H18Na2O6P2.
What is the molecular weight of Disodium cycloheptylaminomethylenediphosphonate?
The molecular weight of Disodium cycloheptylaminomethylenediphosphonate is 330.04 g/mol.
Where can I buy Disodium cycloheptylaminomethylenediphosphonate?
You can request a quote for Disodium cycloheptylaminomethylenediphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Disodium cycloheptylaminomethylenediphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Disodium cycloheptylaminomethylenediphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.