3-Fluorocyclophosphamide
TL;DR: 3-Fluorocyclophosphamide (CAS 87154-28-7) is a chemical compound with molecular formula C7H14Cl2FN2O2P and molecular weight 278.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-bis(2-chloroethyl)-3-fluoro-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: 3-Fluorocyclophosphamide, N,N-bis(2-chloroethyl)-3-fluoro-2-oxo-1,3,2, 2H-1,3,2-Oxazaphosphorin-2-amine, N,N-bis(2-chloroethyl)-3-fluorotetrahydro-, 2-oxide, 2-[Bis(2-chloroethyl)amino]-3-fluoro-1,3,2lambda~5~-oxazaphosphinan-2-one
| Molecular Formula | C7H14Cl2FN2O2P |
|---|---|
| Molecular Weight | 278.02 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.0154 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 87154-28-7 |
|---|---|
| SMILES | C1CN(P(=O)(OC1)N(CCCl)CCCl)F |
| InChIKey | VEFRMVJJFAKPQA-UHFFFAOYSA-N |
Product Overview
3-Fluorocyclophosphamide (CAS 87154-28-7), with molecular formula C7H14Cl2FN2O2P and molecular weight 278.02 g/mol. IUPAC: N,N-bis(2-chloroethyl)-3-fluoro-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of 3-Fluorocyclophosphamide
Property Insights of 3-Fluorocyclophosphamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Fluorocyclophosphamide. With a topological polar surface area (TPSA) of 32.8 Ų, 3-Fluorocyclophosphamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluorocyclophosphamide has 0 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 3-Fluorocyclophosphamide?
The CAS number of 3-Fluorocyclophosphamide is 87154-28-7.
What is the molecular formula of 3-Fluorocyclophosphamide?
The molecular formula of 3-Fluorocyclophosphamide is C7H14Cl2FN2O2P.
What is the molecular weight of 3-Fluorocyclophosphamide?
The molecular weight of 3-Fluorocyclophosphamide is 278.02 g/mol.
Where can I buy 3-Fluorocyclophosphamide?
You can request a quote for 3-Fluorocyclophosphamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluorocyclophosphamide?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluorocyclophosphamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.