Defosfamide
TL;DR: Defosfamide (CAS 3733-81-1) is a chemical compound with molecular formula C9H20Cl3N2O3P and molecular weight 340.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]amino]propan-1-ol
Also Known As: Defosfamide, Desmofosfamide, Defosfamid, Mitarson, Desmophosphamidum
| Molecular Formula | C9H20Cl3N2O3P |
|---|---|
| Molecular Weight | 340.03 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 61.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 340.0277 |
| Heavy Atoms | 18 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 3733-81-1 |
|---|---|
| SMILES | C(CNP(=O)(N(CCCl)CCCl)OCCCl)CO |
| InChIKey | FQWNGSKQHPNIQG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Defosfamide (CAS 3733-81-1), with molecular formula C9H20Cl3N2O3P and molecular weight 340.03 g/mol. IUPAC: 3-[[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]amino]propan-1-ol.
Chemical Property Profile of Defosfamide
Property Insights of Defosfamide
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Defosfamide. The TPSA of 61.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Defosfamide. Following Lipinski's Rule of Five, Defosfamide has 2 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 Defosfamide?
The CAS number of Defosfamide is 3733-81-1.
What is the molecular formula of Defosfamide?
The molecular formula of Defosfamide is C9H20Cl3N2O3P.
What is the molecular weight of Defosfamide?
The molecular weight of Defosfamide is 340.03 g/mol.
Where can I buy Defosfamide?
You can request a quote for Defosfamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Defosfamide?
Yes, KEHONG BIO provides custom synthesis services for Defosfamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.