RefChem:267724
TL;DR: RefChem:267724 (CAS 78149-83-4) 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.
N-(2-chloroethyl)-N-(2-chloropropyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine
Also Known As: Cyclophosphamide Impurity 17, B 691, B-691, Tetrahydro-2-(N-(2-chloroethyl)-N-(2-chloropropyl)amino)-2H-1,3,2-oxazaphosphorine 2-oxide, 2H-1,3,2-Oxazaphosphorin-2-amine, N-(2-chloroethyl)-N-(2-chloropropyl)tetrahydro-, 2-oxide
| Molecular Formula | C8H17Cl2N2O2P |
|---|---|
| Molecular Weight | 274.04 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 | 274.04047 |
| Heavy Atoms | 15 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 78149-83-4 |
|---|---|
| SMILES | CC(CN(CCCl)P1(=O)NCCCO1)Cl |
| InChIKey | SMERYMOESUHYBH-UHFFFAOYSA-N |
Product Overview
RefChem:267724 (CAS 78149-83-4), with molecular formula C8H17Cl2N2O2P and molecular weight 274.04 g/mol. IUPAC: N-(2-chloroethyl)-N-(2-chloropropyl)-2-oxo-1,3,2λ5-oxazaphosphinan-2-amine.
Chemical Property Profile of RefChem:267724
Property Insights of RefChem:267724
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for RefChem:267724. With a topological polar surface area (TPSA) of 41.6 Ų, RefChem:267724 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:267724 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 RefChem:267724?
The CAS number of RefChem:267724 is 78149-83-4.
What is the molecular formula of RefChem:267724?
The molecular formula of RefChem:267724 is C8H17Cl2N2O2P.
What is the molecular weight of RefChem:267724?
The molecular weight of RefChem:267724 is 274.04 g/mol.
Where can I buy RefChem:267724?
You can request a quote for RefChem:267724 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:267724?
Yes, KEHONG BIO provides custom synthesis services for RefChem:267724 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.