N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride
TL;DR: N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride (CAS 60106-93-6) is a chemical compound with molecular formula C8H18Cl3N2OP and molecular weight 294.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[chloro(diethylamino)phosphoryl]-N-(2-chloroethyl)ethanamine
Also Known As: N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride, 2-chloro-N-[chloro(diethylamino)phosphoryl]-N-(2-chloroethyl, 2-chloro-N-[chloro(diethylamino)phosphoryl]-N-(2-chloroethyl)ethanamine, N-[BIS(2-CHLOROETHYL)AMINO-CHLORO-PHOSPHORYL]-N-ETHYL-ETHANAMINE
| Molecular Formula | C8H18Cl3N2OP |
|---|---|
| Molecular Weight | 294.02 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 23.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 294.02225 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 60106-93-6 |
|---|---|
| SMILES | CCN(CC)P(=O)(N(CCCl)CCCl)Cl |
| InChIKey | RCUAZAMLVYMGAG-UHFFFAOYSA-N |
Product Overview
N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride (CAS 60106-93-6), with molecular formula C8H18Cl3N2OP and molecular weight 294.02 g/mol. IUPAC: 2-chloro-N-[chloro(diethylamino)phosphoryl]-N-(2-chloroethyl)ethanamine.
Chemical Property Profile of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride
Property Insights of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride. With a topological polar surface area (TPSA) of 23.6 Ų, N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride has 0 hydrogen bond donor(s) and 3 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 N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride?
The CAS number of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride is 60106-93-6.
What is the molecular formula of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride?
The molecular formula of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride is C8H18Cl3N2OP.
What is the molecular weight of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride?
The molecular weight of N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride is 294.02 g/mol.
Where can I buy N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride?
You can request a quote for N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride?
Yes, KEHONG BIO provides custom synthesis services for N,N-Bis(2-chloroethyl)-N',N'-diethylphosphorodiamidic chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.