Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-
TL;DR: Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- (CAS 61367-11-1) is a chemical compound with molecular formula C11H18ClN3O4 and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexyl]methyl formate
Also Known As: Urea, trans-, NIOSH/YS4980050, Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-, (4-{[(2-chloroethyl)(nitroso)carbamoyl]amino}cyclohexyl)methyl formate, trans-1-(2-Chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitrosourea formate
| Molecular Formula | C11H18ClN3O4 |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 88.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.09857 |
| Heavy Atoms | 19 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 61367-11-1 |
|---|---|
| SMILES | C1CC(CCC1COC=O)NC(=O)N(CCCl)N=O |
| InChIKey | SRQNUXJSEHVLFS-UHFFFAOYSA-N |
Product Overview
Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- (CAS 61367-11-1), with molecular formula C11H18ClN3O4 and molecular weight 291.10 g/mol. IUPAC: [4-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexyl]methyl formate.
Chemical Property Profile of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-
Property Insights of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-. The TPSA of 88.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-. Following Lipinski's Rule of Five, Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- 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, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-?
The CAS number of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- is 61367-11-1.
What is the molecular formula of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-?
The molecular formula of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- is C11H18ClN3O4.
What is the molecular weight of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-?
The molecular weight of Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- is 291.10 g/mol.
Where can I buy Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-?
You can request a quote for Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)-?
Yes, KEHONG BIO provides custom synthesis services for Urea, 1-(2-chloroethyl)-3-(4-hydroxymethylcyclohexyl)-1-nitroso-, formate, (E)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.