2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate
TL;DR: 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate (CAS 78218-97-0) is a chemical compound with molecular formula C10H22Cl3N2O3P and molecular weight 354.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]-3-methoxypropan-1-amine
Also Known As: B 719, B-719, Phosphorodiamidic acid, N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)-, (2-chloroethyl) ester, 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate, [(2-chloroethoxy)[(3-methoxypropyl)amino]phosphoryl]bis(2-chloroethyl)amine
| Molecular Formula | C10H22Cl3N2O3P |
|---|---|
| Molecular Weight | 354.04 g/mol |
| LogP | 2.7556 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 13 |
| Exact Mass | 354.04337 |
| Heavy Atoms | 19 |
| Complexity | 256.17438 |
Chemical Identifiers
| CAS Number | 78218-97-0 |
|---|---|
| SMILES | COCCCNP(=O)(N(CCCl)CCCl)OCCCl |
Product Overview
2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate (CAS 78218-97-0), with molecular formula C10H22Cl3N2O3P and molecular weight 354.04 g/mol. IUPAC: N-[bis(2-chloroethyl)amino-(2-chloroethoxy)phosphoryl]-3-methoxypropan-1-amine.
Chemical Property Profile of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate
Property Insights of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate
The XLogP value of 2.7556 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate. With a topological polar surface area (TPSA) of 50.8 Ų, 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate has 1 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-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate?
The CAS number of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate is 78218-97-0.
What is the molecular formula of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate?
The molecular formula of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate is C10H22Cl3N2O3P.
What is the molecular weight of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate?
The molecular weight of 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate is 354.04 g/mol.
Where can I buy 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate?
You can request a quote for 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl N,N-bis(2-chloroethyl)-N'-(3-methoxypropyl)phosphorodiamidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.