![N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea structure](/static/products/7054/70540-28-2.webp)
N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea
TL;DR: N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea (CAS 70540-28-2) is a chemical compound with molecular formula C16H24N2O and molecular weight 260.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-3-(2-methylbut-3-yn-2-yl)urea
Also Known As: 1-(1-adamantyl)-3-(2-methylbut-3-yn-2-yl)urea, N-(Adamantan-1-yl)-N'-(2-methylbut-3-yn-2-yl)urea, N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea
| Molecular Formula | C16H24N2O |
|---|---|
| Molecular Weight | 260.19 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.18887 |
| Heavy Atoms | 19 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 70540-28-2 |
|---|---|
| SMILES | CC(C)(C#C)NC(=O)NC12CC3CC(C1)CC(C3)C2 |
| InChIKey | NWSJSPBJZCPUQZ-UHFFFAOYSA-N |
Product Overview
N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea (CAS 70540-28-2), with molecular formula C16H24N2O and molecular weight 260.19 g/mol. IUPAC: 1-(1-adamantyl)-3-(2-methylbut-3-yn-2-yl)urea.
Chemical Property Profile of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea
Property Insights of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea. With a topological polar surface area (TPSA) of 41.1 Ų, N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea has 2 hydrogen bond donor(s) and 1 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 N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea?
The CAS number of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea is 70540-28-2.
What is the molecular formula of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea?
The molecular formula of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea is C16H24N2O.
What is the molecular weight of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea?
The molecular weight of N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea is 260.19 g/mol.
Where can I buy N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea?
You can request a quote for N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-Methylbut-3-yn-2-yl)-N'-tricyclo[3.3.1.1~3,7~]decan-1-ylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.