N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid
TL;DR: N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid (CAS 67227-29-6) is a chemical compound with molecular formula C10H16ClN3O4 and molecular weight 277.08 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] formate
Also Known As: trans-1-(2-Chloroethyl)-3-(4-hydroxycyclohexyl)-1-nitrosourea formate, Urea, 1-(2-chloroethyl)-3-(4-hydroxycyclohexyl)-1-nitroso-, formate (E)-, [4-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexyl] formate, Formic acid, 4-(3-(2-chloroethyl)-3-nitrosoureido)cyclohexyl ester, (E)-, N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid
| Molecular Formula | C10H16ClN3O4 |
|---|---|
| Molecular Weight | 277.08 g/mol |
| LogP | 1.4024 |
| Topological Polar Surface Area | 88.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.08295 |
| Heavy Atoms | 18 |
| Complexity | 294.84738 |
Chemical Identifiers
| CAS Number | 67227-29-6 |
|---|---|
| SMILES | C1CC(CCC1NC(=O)N(CCCl)N=O)OC=O |
Product Overview
N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid (CAS 67227-29-6), with molecular formula C10H16ClN3O4 and molecular weight 277.08 g/mol. IUPAC: [4-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexyl] formate.
Chemical Property Profile of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid
Property Insights of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid
The XLogP value of 1.4024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid. The TPSA of 88.07 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid. Following Lipinski's Rule of Five, N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid 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 N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid?
The CAS number of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid is 67227-29-6.
What is the molecular formula of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid?
The molecular formula of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid is C10H16ClN3O4.
What is the molecular weight of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid?
The molecular weight of N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid is 277.08 g/mol.
Where can I buy N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid?
You can request a quote for N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Chloroethyl)-N'-(4-(formyloxy)cyclohexyl)-N-nitrosocarbamimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.