Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate
TL;DR: Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate (CAS 70772-68-8) is a chemical compound with molecular formula C10H15Cl2N2O2P and molecular weight 296.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(2-chloroethylamino)-phenoxyphosphoryl]ethanamine
Also Known As: 2-Cyano-3,5-dichloropyridine, PHENYLN,N'-BIS PHOSPHORODIAMIDATE, PHENYL N,N'-BIS(2-CHLOROETHYL)PHOSPHORODIAMIDATE, phenyl bis((2-chloroethyl)-l2-azaneyl)phosphinate, 2-chloro-N-[(2-chloroethylamino)-phenoxyphosphoryl]ethanamine
| Molecular Formula | C10H15Cl2N2O2P |
|---|---|
| Molecular Weight | 296.02 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 296.0248 |
| Heavy Atoms | 17 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 70772-68-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)OP(=O)(NCCCl)NCCCl |
| InChIKey | MXGQLWMLQRDZBT-UHFFFAOYSA-N |
Product Overview
Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate (CAS 70772-68-8), with molecular formula C10H15Cl2N2O2P and molecular weight 296.02 g/mol. IUPAC: 2-chloro-N-[(2-chloroethylamino)-phenoxyphosphoryl]ethanamine.
Chemical Property Profile of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate
Property Insights of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate. With a topological polar surface area (TPSA) of 50.4 Ų, Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate has 2 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 Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The CAS number of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate is 70772-68-8.
What is the molecular formula of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The molecular formula of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate is C10H15Cl2N2O2P.
What is the molecular weight of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
The molecular weight of Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate is 296.02 g/mol.
Where can I buy Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
You can request a quote for Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate?
Yes, KEHONG BIO provides custom synthesis services for Phenyl N,N'-bis(2-chloroethyl)phosphorodiamidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.