[[2-(1-Chloroethylidene)cyclohexylidene]amino]urea
TL;DR: [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea (CAS 16111-97-0) is a chemical compound with molecular formula C9H14ClN3O and molecular weight 215.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[[2-(1-chloroethylidene)cyclohexylidene]amino]urea
Also Known As: [[2-(1-chloroethylidene)cyclohexylidene]amino]urea|[(Z)-[(2Z)-2-(1-chloroethylidene)cyclohexylidene]amino]urea|2-[2-(1-chloroethylidene)cyclohexylidene]hydrazinecarboxamide
| Molecular Formula | C9H14ClN3O |
|---|---|
| Molecular Weight | 215.08 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 215.08253 |
| Heavy Atoms | 14 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 16111-97-0 |
|---|---|
| SMILES | CC(=C1CCCCC1=NNC(=O)N)Cl |
| InChIKey | OXDGGJGBRDMARR-UHFFFAOYSA-N |
Product Overview
[[2-(1-Chloroethylidene)cyclohexylidene]amino]urea (CAS 16111-97-0), with molecular formula C9H14ClN3O and molecular weight 215.08 g/mol. IUPAC: [[2-(1-chloroethylidene)cyclohexylidene]amino]urea.
Chemical Property Profile of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea
Property Insights of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea. Following Lipinski's Rule of Five, [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea has 2 hydrogen bond donor(s) and 2 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 [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea?
The CAS number of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea is 16111-97-0.
What is the molecular formula of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea?
The molecular formula of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea is C9H14ClN3O.
What is the molecular weight of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea?
The molecular weight of [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea is 215.08 g/mol.
Where can I buy [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea?
You can request a quote for [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea?
Yes, KEHONG BIO provides custom synthesis services for [[2-(1-Chloroethylidene)cyclohexylidene]amino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.