5-Bromocyclophosphamide
TL;DR: 5-Bromocyclophosphamide (CAS 101834-45-1) is a chemical compound with molecular formula C7H14BrCl2N2O2P and molecular weight 337.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-bromo-N,N-bis(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: 5-Bromo-cyclophosphamide, 5-Bromocyclophosphamide, 2-(Bis(2-chloroethyl)amino)tetrahydro-5-bromo-2H-1,3,2-oxazaphosphorine 2-oxide, 5-bromo-N,N-bis(2-chloroethyl)-2-oxo-1,3,2, 2H-1,3,2-Oxazaphosphorine, tetrahydro-2-(bis(2-chloroethyl)amino)-5-bromo-, 2-oxide
| Molecular Formula | C7H14BrCl2N2O2P |
|---|---|
| Molecular Weight | 337.94 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.93533 |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 101834-45-1 |
|---|---|
| SMILES | C1C(COP(=O)(N1)N(CCCl)CCCl)Br |
| InChIKey | FANXZPANFQUGNC-UHFFFAOYSA-N |
Product Overview
5-Bromocyclophosphamide (CAS 101834-45-1), with molecular formula C7H14BrCl2N2O2P and molecular weight 337.94 g/mol. IUPAC: 5-bromo-N,N-bis(2-chloroethyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of 5-Bromocyclophosphamide
Property Insights of 5-Bromocyclophosphamide
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Bromocyclophosphamide. With a topological polar surface area (TPSA) of 41.6 Ų, 5-Bromocyclophosphamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Bromocyclophosphamide 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
Frequently Asked Questions
What is the CAS number of 5-Bromocyclophosphamide?
The CAS number of 5-Bromocyclophosphamide is 101834-45-1.
What is the molecular formula of 5-Bromocyclophosphamide?
The molecular formula of 5-Bromocyclophosphamide is C7H14BrCl2N2O2P.
What is the molecular weight of 5-Bromocyclophosphamide?
The molecular weight of 5-Bromocyclophosphamide is 337.94 g/mol.
Where can I buy 5-Bromocyclophosphamide?
You can request a quote for 5-Bromocyclophosphamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Bromocyclophosphamide?
Yes, KEHONG BIO provides custom synthesis services for 5-Bromocyclophosphamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.