4-Methylcyclophosphamide
TL;DR: 4-Methylcyclophosphamide (CAS 57604-37-2) is a chemical compound with molecular formula C8H17Cl2N2O2P and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R,4R)-N,N-bis(2-chloroethyl)-4-methyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: 4-Methylcyclophosphamide, (-)-cis-4-Methylcyclophosphamide, cis-4-Methylcyclophosphamide, trans-4-Methylcyclophosphamide, (+-)-trans-4-Methylcyclophosphamide
| Molecular Formula | C8H17Cl2N2O2P |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 2.2725 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 274.04047 |
| Heavy Atoms | 15 |
| Complexity | 236.68156 |
Chemical Identifiers
| CAS Number | 57604-37-2 |
|---|---|
| SMILES | C[C@@H]1CCO[P@](=O)(N1)N(CCCl)CCCl |
Product Overview
4-Methylcyclophosphamide (CAS 57604-37-2), with molecular formula C8H17Cl2N2O2P and molecular weight 274.04 g/mol. IUPAC: (2R,4R)-N,N-bis(2-chloroethyl)-4-methyl-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of 4-Methylcyclophosphamide
Property Insights of 4-Methylcyclophosphamide
The XLogP value of 2.2725 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methylcyclophosphamide. With a topological polar surface area (TPSA) of 41.57 Ų, 4-Methylcyclophosphamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methylcyclophosphamide has 1 hydrogen bond donor(s) and 2 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 4-Methylcyclophosphamide?
The CAS number of 4-Methylcyclophosphamide is 57604-37-2.
What is the molecular formula of 4-Methylcyclophosphamide?
The molecular formula of 4-Methylcyclophosphamide is C8H17Cl2N2O2P.
What is the molecular weight of 4-Methylcyclophosphamide?
The molecular weight of 4-Methylcyclophosphamide is 274.04 g/mol.
Where can I buy 4-Methylcyclophosphamide?
You can request a quote for 4-Methylcyclophosphamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methylcyclophosphamide?
Yes, KEHONG BIO provides custom synthesis services for 4-Methylcyclophosphamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.