![1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea structure](/static/products/3317/3317-99-5.webp)
1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea
TL;DR: 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea (CAS 3317-99-5) is a chemical compound with molecular formula C13H21FN2O and molecular weight 240.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-adamantyl)-3-(2-fluoroethyl)urea
Also Known As: 1-(2-adamantyl)-3-(2-fluoroethyl)urea, KST-1B3192, 1-(2-fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea, N-(Adamantan-2-yl)-N'-(2-fluoroethyl)urea, N-Adamantan-2-yl-N'-(2-fluor-aethyl)-harnstoff
| Molecular Formula | C13H21FN2O |
|---|---|
| Molecular Weight | 240.16 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 240.16379 |
| Heavy Atoms | 17 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 3317-99-5 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)C3NC(=O)NCCF |
| InChIKey | DUSFLQCEUXZSMO-UHFFFAOYSA-N |
Product Overview
1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea (CAS 3317-99-5), with molecular formula C13H21FN2O and molecular weight 240.16 g/mol. IUPAC: 1-(2-adamantyl)-3-(2-fluoroethyl)urea.
Chemical Property Profile of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea
Property Insights of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea. With a topological polar surface area (TPSA) of 41.1 Ų, 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea 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-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea?
The CAS number of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea is 3317-99-5.
What is the molecular formula of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea?
The molecular formula of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea is C13H21FN2O.
What is the molecular weight of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea?
The molecular weight of 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea is 240.16 g/mol.
Where can I buy 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea?
You can request a quote for 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Fluoroethyl)-3-tricyclo[3.3.1.13,7]dec-2-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.