Aldophosphamide diethyl acetal
TL;DR: Aldophosphamide diethyl acetal (CAS 40255-60-5) is a chemical compound with molecular formula C11H25Cl2N2O4P and molecular weight 350.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[amino(3,3-diethoxypropoxy)phosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine
Also Known As: Aldophosphamide diethyl acetal, 3,3-diethoxypropyl n,n-bis(2-chloroethyl)phosphorodiamidate, N-[amino(3,3-diethoxypropoxy)phosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine
| Molecular Formula | C11H25Cl2N2O4P |
|---|---|
| Molecular Weight | 350.09 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 74.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 13 |
| Exact Mass | 350.0929 |
| Heavy Atoms | 20 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 40255-60-5 |
|---|---|
| SMILES | CCOC(CCOP(=O)(N)N(CCCl)CCCl)OCC |
| InChIKey | HAUWHFROJHPKIL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Aldophosphamide diethyl acetal (CAS 40255-60-5), with molecular formula C11H25Cl2N2O4P and molecular weight 350.09 g/mol. IUPAC: N-[amino(3,3-diethoxypropoxy)phosphoryl]-2-chloro-N-(2-chloroethyl)ethanamine.
Chemical Property Profile of Aldophosphamide diethyl acetal
Property Insights of Aldophosphamide diethyl acetal
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Aldophosphamide diethyl acetal. The TPSA of 74.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Aldophosphamide diethyl acetal. Following Lipinski's Rule of Five, Aldophosphamide diethyl acetal has 1 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 Aldophosphamide diethyl acetal?
The CAS number of Aldophosphamide diethyl acetal is 40255-60-5.
What is the molecular formula of Aldophosphamide diethyl acetal?
The molecular formula of Aldophosphamide diethyl acetal is C11H25Cl2N2O4P.
What is the molecular weight of Aldophosphamide diethyl acetal?
The molecular weight of Aldophosphamide diethyl acetal is 350.09 g/mol.
Where can I buy Aldophosphamide diethyl acetal?
You can request a quote for Aldophosphamide diethyl acetal directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Aldophosphamide diethyl acetal?
Yes, KEHONG BIO provides custom synthesis services for Aldophosphamide diethyl acetal and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.