2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate
TL;DR: 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate (CAS 78218-71-0) is a chemical compound with molecular formula C8H17Cl3NO4P and molecular weight 327.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]oxyethanol
Also Known As: B 641, B641, 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate, B-641, 2-[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]oxyethanol
| Molecular Formula | C8H17Cl3NO4P |
|---|---|
| Molecular Weight | 327.00 g/mol |
| LogP | 2.1384 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 326.99606 |
| Heavy Atoms | 17 |
| Complexity | 216.81583 |
Chemical Identifiers
| CAS Number | 78218-71-0 |
|---|---|
| SMILES | C(CCl)N(CCCl)P(=O)(OCCO)OCCCl |
Product Overview
2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate (CAS 78218-71-0), with molecular formula C8H17Cl3NO4P and molecular weight 327.00 g/mol. IUPAC: 2-[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]oxyethanol.
Chemical Property Profile of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate
Property Insights of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate
The XLogP value of 2.1384 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate. With a topological polar surface area (TPSA) of 59.0 Ų, 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate 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 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate?
The CAS number of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate is 78218-71-0.
What is the molecular formula of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate?
The molecular formula of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate is C8H17Cl3NO4P.
What is the molecular weight of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate?
The molecular weight of 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate is 327.00 g/mol.
Where can I buy 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate?
You can request a quote for 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl 2-hydroxyethyl N,N-bis(2-chloroethyl)phosphoramidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.