Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-
TL;DR: Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- (CAS 69000-73-3) is a chemical compound with molecular formula C13H22ClN5O4 and molecular weight 347.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-[4-(4-ethyl-2,3-dioxopiperazin-1-yl)butyl]-1-nitrosourea
Also Known As: 5-24-05-00291 (Beilstein Handbook Reference), Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-, N-(2-Chloroethyl)-N'-(4-(4-ethyl-2,3-dioxo-1-piperazinyl)butyl)-N-nitrosourea, 1-(2-chloroethyl)-3-[4-(4-ethyl-2,3-dioxopiperazin-1-yl)butyl]-1-nitrosourea, N-(2-Chloroethyl)-N'-[4-(4-ethyl-2,3-dioxopiperazin-1-yl)butyl]-N-nitrosourea
| Molecular Formula | C13H22ClN5O4 |
|---|---|
| Molecular Weight | 347.14 g/mol |
| LogP | 0.3891 |
| Topological Polar Surface Area | 102.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 347.13602 |
| Heavy Atoms | 23 |
| Complexity | 448.0808 |
Chemical Identifiers
| CAS Number | 69000-73-3 |
|---|---|
| SMILES | CCN1CCN(C(=O)C1=O)CCCCNC(=O)N(CCCl)N=O |
Product Overview
Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- (CAS 69000-73-3), with molecular formula C13H22ClN5O4 and molecular weight 347.14 g/mol. IUPAC: 1-(2-chloroethyl)-3-[4-(4-ethyl-2,3-dioxopiperazin-1-yl)butyl]-1-nitrosourea.
Chemical Property Profile of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-
Property Insights of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-
The XLogP value of 0.3891 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-. The TPSA of 102.39 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-. Following Lipinski's Rule of Five, Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- has 1 hydrogen bond donor(s) and 5 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 Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-?
The CAS number of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- is 69000-73-3.
What is the molecular formula of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-?
The molecular formula of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- is C13H22ClN5O4.
What is the molecular weight of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-?
The molecular weight of Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- is 347.14 g/mol.
Where can I buy Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-?
You can request a quote for Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(2-chloroethyl)-N'-(4-(2,3-dioxo-4-ethyl-1-piperazinyl)butyl)-N-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.