trans-6-Phenylcyclophosphamide
TL;DR: trans-6-Phenylcyclophosphamide (CAS 136185-84-7) is a chemical compound with molecular formula C13H19Cl2N2O2P and molecular weight 336.05612 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,6S)-N,N-bis(2-chloroethyl)-2-oxo-6-phenyl-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: trans-6-Phenylcyclophosphamide, cis-6-Phenylcyclophosphamide, 2H-1,3,2-Oxazaphosphorin-2-amine, tetrahydro-N,N-bis(2-chloroethyl)-6-phenyl-, 2-oxide, trans-, (2S,6S)-2-[Bis(2-chloroethyl)amino]-6-phenyl-1,3,2lambda~5~-oxazaphosphinan-2-one
Technical Specifications
| Molecular Formula | C13H19Cl2N2O2P |
| Molecular Weight | 336.05612 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 336.05612 Da |
| Heavy Atoms | 20 |
| Complexity | 334.0 |
| SMILES | C1CN[P@](=O)(O[C@@H]1C2=CC=CC=C2)N(CCCl)CCCl |
| InChIKey | YZQPJPPCVSPBSH-RBZFPXEDSA-N |
Chemical Property Profile of trans-6-Phenylcyclophosphamide
Property Insights of trans-6-Phenylcyclophosphamide
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for trans-6-Phenylcyclophosphamide. With a topological polar surface area (TPSA) of 41.6 Ų, trans-6-Phenylcyclophosphamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, trans-6-Phenylcyclophosphamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of trans-6-Phenylcyclophosphamide?
The CAS number of trans-6-Phenylcyclophosphamide is 136185-84-7.
What is the molecular formula of trans-6-Phenylcyclophosphamide?
The molecular formula of trans-6-Phenylcyclophosphamide is C13H19Cl2N2O2P.
What is the molecular weight of trans-6-Phenylcyclophosphamide?
The molecular weight of trans-6-Phenylcyclophosphamide is 336.05612 g/mol.
Where can I buy trans-6-Phenylcyclophosphamide?
You can request a quote for trans-6-Phenylcyclophosphamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for trans-6-Phenylcyclophosphamide?
Yes, CoreyChem provides custom synthesis services for trans-6-Phenylcyclophosphamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.