Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-
TL;DR: Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- (CAS 89774-74-3) is a chemical compound with molecular formula C7H12Cl3N3O2 and molecular weight 275.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,3-tris(2-chloroethyl)-3-nitrosourea
Also Known As: NTCU, Nitrosotris(chloroethyl)urea, N-Nitrosotris-(2-chloroethyl)urea 90%, 1,1,3-tris(2-chloroethyl)-3-nitrosourea, n-nitroso-tris-chloroethylurea
| Molecular Formula | C7H12Cl3N3O2 |
|---|---|
| Molecular Weight | 275.00 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 53.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.9995 |
| Heavy Atoms | 15 |
| Complexity | 200.0 |
Chemical Identifiers
| CAS Number | 89774-74-3 |
|---|---|
| SMILES | C(CCl)N(CCCl)C(=O)N(CCCl)N=O |
| InChIKey | KIRNCVMRJCUYPS-UHFFFAOYSA-N |
Product Overview
Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- (CAS 89774-74-3), with molecular formula C7H12Cl3N3O2 and molecular weight 275.00 g/mol. IUPAC: 1,1,3-tris(2-chloroethyl)-3-nitrosourea.
Chemical Property Profile of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-
Property Insights of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-. With a topological polar surface area (TPSA) of 53.0 Ų, Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- 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 Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-?
The CAS number of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- is 89774-74-3.
What is the molecular formula of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-?
The molecular formula of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- is C7H12Cl3N3O2.
What is the molecular weight of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-?
The molecular weight of Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- is 275.00 g/mol.
Where can I buy Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-?
You can request a quote for Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-nitroso-1,3,3-tris(2-chloroethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.