cis-Cccnu
TL;DR: cis-Cccnu (CAS 42558-93-0) 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]cyclohexane-1-carboxylic acid
Also Known As: cis-Cccnu, Cis-acid, Cyclohexanecarboxylic acid, cis-, Cyclohexanecarboxylic acid, (E)-, Cyclohexanecarboxylic acid, (Z)-
| Molecular Formula | C10H16ClN3O4 |
|---|---|
| Molecular Weight | 277.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 99.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 277.08295 |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
Chemical Identifiers
| CAS Number | 42558-93-0 |
|---|---|
| SMILES | C1CC(CCC1C(=O)O)NC(=O)N(CCCl)N=O |
| InChIKey | VGKZBAMIYUHSMU-UHFFFAOYSA-N |
Product Overview
cis-Cccnu (CAS 42558-93-0), with molecular formula C10H16ClN3O4 and molecular weight 277.08 g/mol. IUPAC: 4-[[2-chloroethyl(nitroso)carbamoyl]amino]cyclohexane-1-carboxylic acid.
Chemical Property Profile of cis-Cccnu
Property Insights of cis-Cccnu
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-Cccnu. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for cis-Cccnu. Following Lipinski's Rule of Five, cis-Cccnu has 2 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 cis-Cccnu?
The CAS number of cis-Cccnu is 42558-93-0.
What is the molecular formula of cis-Cccnu?
The molecular formula of cis-Cccnu is C10H16ClN3O4.
What is the molecular weight of cis-Cccnu?
The molecular weight of cis-Cccnu is 277.08 g/mol.
Where can I buy cis-Cccnu?
You can request a quote for cis-Cccnu directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-Cccnu?
Yes, KEHONG BIO provides custom synthesis services for cis-Cccnu and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.