2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate
TL;DR: 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate (CAS 105687-87-4) is a chemical compound with molecular formula C8H17Cl3NO2P and molecular weight 295.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(2-chloroethyl)-N-[2-chloropropoxy(methyl)phosphoryl]ethanamine
Also Known As: 2-chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate, 2-chloro-N-(2-chloroethyl)-N-[2-chloropropoxy(methyl)phosphoryl]ethanamine
| Molecular Formula | C8H17Cl3NO2P |
|---|---|
| Molecular Weight | 295.01 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 295.00626 |
| Heavy Atoms | 15 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 105687-87-4 |
|---|---|
| SMILES | CC(COP(=O)(C)N(CCCl)CCCl)Cl |
| InChIKey | ZGLSLIUHNCLRIM-UHFFFAOYSA-N |
Product Overview
2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate (CAS 105687-87-4), with molecular formula C8H17Cl3NO2P and molecular weight 295.01 g/mol. IUPAC: 2-chloro-N-(2-chloroethyl)-N-[2-chloropropoxy(methyl)phosphoryl]ethanamine.
Chemical Property Profile of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate
Property Insights of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate. With a topological polar surface area (TPSA) of 29.5 Ų, 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate 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 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate?
The CAS number of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate is 105687-87-4.
What is the molecular formula of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate?
The molecular formula of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate is C8H17Cl3NO2P.
What is the molecular weight of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate?
The molecular weight of 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate is 295.01 g/mol.
Where can I buy 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate?
You can request a quote for 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloropropyl n,n-bis(2-chloroethyl)-p-methylphosphonamidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.