![1-[(Adamantan-1-yl)methyl]-3-butylurea structure](/static/products/1948/194801-47-3.webp)
1-[(Adamantan-1-yl)methyl]-3-butylurea
TL;DR: 1-[(Adamantan-1-yl)methyl]-3-butylurea (CAS 194801-47-3) is a chemical compound with molecular formula C16H28N2O and molecular weight 264.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantylmethyl)-3-butylurea
Also Known As: 1-[(adamantan-1-yl)methyl]-3-butylurea, 1-(1-adamantylmethyl)-3-butylurea, N-(1-adamantylmethyl)-N'-butylurea, N-(adamantanylmethyl)(butylamino)carboxamide, 1-((3r,5r,7r)-adamantan-1-ylmethyl)-3-butylurea
| Molecular Formula | C16H28N2O |
|---|---|
| Molecular Weight | 264.22 g/mol |
| LogP | 3.3021 |
| Topological Polar Surface Area | 41.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 264.22015 |
| Heavy Atoms | 19 |
| Complexity | 304.3564 |
Chemical Identifiers
| CAS Number | 194801-47-3 |
|---|---|
| SMILES | CCCCNC(=O)NCC12CC3CC(C1)CC(C3)C2 |
Product Overview
1-[(Adamantan-1-yl)methyl]-3-butylurea (CAS 194801-47-3), with molecular formula C16H28N2O and molecular weight 264.22 g/mol. IUPAC: 1-(1-adamantylmethyl)-3-butylurea.
Chemical Property Profile of 1-[(Adamantan-1-yl)methyl]-3-butylurea
Property Insights of 1-[(Adamantan-1-yl)methyl]-3-butylurea
The XLogP value of 3.3021 indicates that 1-[(Adamantan-1-yl)methyl]-3-butylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.13 Ų, 1-[(Adamantan-1-yl)methyl]-3-butylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(Adamantan-1-yl)methyl]-3-butylurea 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 1-[(Adamantan-1-yl)methyl]-3-butylurea?
The CAS number of 1-[(Adamantan-1-yl)methyl]-3-butylurea is 194801-47-3.
What is the molecular formula of 1-[(Adamantan-1-yl)methyl]-3-butylurea?
The molecular formula of 1-[(Adamantan-1-yl)methyl]-3-butylurea is C16H28N2O.
What is the molecular weight of 1-[(Adamantan-1-yl)methyl]-3-butylurea?
The molecular weight of 1-[(Adamantan-1-yl)methyl]-3-butylurea is 264.22 g/mol.
Where can I buy 1-[(Adamantan-1-yl)methyl]-3-butylurea?
You can request a quote for 1-[(Adamantan-1-yl)methyl]-3-butylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(Adamantan-1-yl)methyl]-3-butylurea?
Yes, KEHONG BIO provides custom synthesis services for 1-[(Adamantan-1-yl)methyl]-3-butylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.