[(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea
TL;DR: [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea (CAS 91843-45-7) is a chemical compound with molecular formula C12H21N3O and molecular weight 223.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea
Also Known As: [(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)methylideneamino]urea|[(E)-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)methylideneam
| Molecular Formula | C12H21N3O |
|---|---|
| Molecular Weight | 223.17 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 67.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.16846 |
| Heavy Atoms | 16 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 91843-45-7 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2)C=NNC(=O)N)C)C |
| InChIKey | YLVNMDLQYFEFCH-UHFFFAOYSA-N |
Product Overview
[(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea (CAS 91843-45-7), with molecular formula C12H21N3O and molecular weight 223.17 g/mol. IUPAC: [(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea.
Chemical Property Profile of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea
Property Insights of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea. The TPSA of 67.5 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea. Following Lipinski's Rule of Five, [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]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 [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea?
The CAS number of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea is 91843-45-7.
What is the molecular formula of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea?
The molecular formula of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea is C12H21N3O.
What is the molecular weight of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea?
The molecular weight of [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea is 223.17 g/mol.
Where can I buy [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea?
You can request a quote for [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [(1,7,7-Trimethyl-2-bicyclo[2.2.1]heptanyl)methylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.