Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-
TL;DR: Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- (CAS 58494-43-2) is a chemical compound with molecular formula C9H16ClN3O3 and molecular weight 249.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-chloroethyl)-3-[(1R,2R)-2-hydroxycyclohexyl]-1-nitrosourea
Also Known As: trans-2-OH-CCNU, G(Anh)mtetra, 2-Hydroxylomustine, Urea, trans-, trans-2-OH CCNU
| Molecular Formula | C9H16ClN3O3 |
|---|---|
| Molecular Weight | 249.09 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 82.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.08801 |
| Heavy Atoms | 16 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 58494-43-2 |
|---|---|
| SMILES | C1CC[C@H]([C@@H](C1)NC(=O)N(CCCl)N=O)O |
| InChIKey | STQSMIAHSQBRBH-HTQZYQBOSA-N |
Product Overview
Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- (CAS 58494-43-2), with molecular formula C9H16ClN3O3 and molecular weight 249.09 g/mol. IUPAC: 1-(2-chloroethyl)-3-[(1R,2R)-2-hydroxycyclohexyl]-1-nitrosourea.
Chemical Property Profile of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-
Property Insights of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-. The TPSA of 82.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-. Following Lipinski's Rule of Five, Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- 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 Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-?
The CAS number of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- is 58494-43-2.
What is the molecular formula of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-?
The molecular formula of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- is C9H16ClN3O3.
What is the molecular weight of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-?
The molecular weight of Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- is 249.09 g/mol.
Where can I buy Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans-?
You can request a quote for Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- 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'-(2-hydroxycyclohexyl)-N-nitroso-, trans-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(2-chloroethyl)-N'-(2-hydroxycyclohexyl)-N-nitroso-, trans- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.