![[(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea structure](/static/products/168/16841-53-5.png)
[(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea
TL;DR: [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea (CAS 16841-53-5) is a chemical compound with molecular formula C14H25N3O and molecular weight 251.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea
Also Known As: 2-[4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylidene]hydrazinecarboxamide
| Molecular Formula | C14H25N3O |
|---|---|
| Molecular Weight | 251.20 g/mol |
| LogP | 3.1933 |
| Topological Polar Surface Area | 67.48 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 251.19977 |
| Heavy Atoms | 18 |
| Complexity | 369.23538 |
Chemical Identifiers
| CAS Number | 16841-53-5 |
|---|---|
| SMILES | CC1=CCCC(C1CC/C(=N/NC(=O)N)/C)(C)C |
Product Overview
[(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea (CAS 16841-53-5), with molecular formula C14H25N3O and molecular weight 251.20 g/mol. IUPAC: [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea.
Chemical Property Profile of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea
Property Insights of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea
The XLogP value of 3.1933 indicates that [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.48 Ų falls within the moderate polarity range, balancing permeability and solubility for [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea. Following Lipinski's Rule of Five, [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]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 [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea?
The CAS number of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea is 16841-53-5.
What is the molecular formula of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea?
The molecular formula of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea is C14H25N3O.
What is the molecular weight of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea?
The molecular weight of [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea is 251.20 g/mol.
Where can I buy [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea?
You can request a quote for [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea?
Yes, KEHONG BIO provides custom synthesis services for [(E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)butan-2-ylideneamino]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.