4-过氧环磷酰胺
TL;DR: 4-过氧环磷酰胺 (CAS 51274-71-6) is a chemical compound with molecular formula C14H28Cl4N4O6P2 and molecular weight 550.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-过氧环磷酰胺
4-[[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2λ5-oxazaphosphinan-4-yl]peroxy]-N,N-bis(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: 4-Peroxycyclophosphamide, 4-Hydroxycyclophosphamide anhydro-dimer, 4-[[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2, 2H-1,3,2-Oxazaphosphorin-2-amine, 4,4'-dioxybis(N,N-bis(2-chloroethyl)tetrahydro-, 2,2'-dioxide, 4,4'-dioxybis[n,n-bis(2-chloroethyl)-1,3,2-oxazaphosphinan-2-amine] 2,2'-dioxide
| Molecular Formula | C14H28Cl4N4O6P2 |
|---|---|
| Molecular Weight | 550.02 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 13 |
| Exact Mass | 552.0209 |
| Heavy Atoms | 30 |
| Complexity | 551.0 |
Chemical Identifiers
| CAS Number | 51274-71-6 |
|---|---|
| SMILES | C1COP(=O)(NC1OOC2CCOP(=O)(N2)N(CCCl)CCCl)N(CCCl)CCCl |
| InChIKey | MBXBDDYOYWGZID-UHFFFAOYSA-N |
Product Overview
4-过氧环磷酰胺 (CAS 51274-71-6), with molecular formula C14H28Cl4N4O6P2 and molecular weight 550.02 g/mol. IUPAC: 4-[[2-[bis(2-chloroethyl)amino]-2-oxo-1,3,2λ5-oxazaphosphinan-4-yl]peroxy]-N,N-bis(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of 4-过氧环磷酰胺
Property Insights of 4-过氧环磷酰胺
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-过氧环磷酰胺. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-过氧环磷酰胺. Following Lipinski's Rule of Five, 4-过氧环磷酰胺 has 2 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-过氧环磷酰胺?
The CAS number of 4-过氧环磷酰胺 is 51274-71-6.
What is the molecular formula of 4-过氧环磷酰胺?
The molecular formula of 4-过氧环磷酰胺 is C14H28Cl4N4O6P2.
What is the molecular weight of 4-过氧环磷酰胺?
The molecular weight of 4-过氧环磷酰胺 is 550.02 g/mol.
Where can I buy 4-过氧环磷酰胺?
You can request a quote for 4-过氧环磷酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-过氧环磷酰胺?
Yes, KEHONG BIO provides custom synthesis services for 4-过氧环磷酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.