N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea
TL;DR: N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea (CAS 54-54-6) is a chemical compound with molecular formula C18H39N3O and molecular weight 313.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(diethylamino)ethyl]-1-(3-methylbutyl)-3,3-di(propan-2-yl)urea
Also Known As: P-286 (Pharmaceutical), P 286 (Pharmaceutical), P286 (pharmaceutical), N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea, N,N-diisopropyl-N'-isopentyl-N'-diethylaminoethylurea
| Molecular Formula | C18H39N3O |
|---|---|
| Molecular Weight | 313.31 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 313.30933 |
| Heavy Atoms | 22 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 54-54-6 |
|---|---|
| SMILES | CCN(CC)CCN(CCC(C)C)C(=O)N(C(C)C)C(C)C |
| InChIKey | PNRXGUVIQVEQMN-UHFFFAOYSA-N |
Product Overview
N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea (CAS 54-54-6), with molecular formula C18H39N3O and molecular weight 313.31 g/mol. IUPAC: 1-[2-(diethylamino)ethyl]-1-(3-methylbutyl)-3,3-di(propan-2-yl)urea.
Chemical Property Profile of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea
Property Insights of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea
The XLogP value of 3.8 indicates that N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.8 Ų, N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea has 0 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 N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea?
The CAS number of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea is 54-54-6.
What is the molecular formula of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea?
The molecular formula of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea is C18H39N3O.
What is the molecular weight of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea?
The molecular weight of N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea is 313.31 g/mol.
Where can I buy N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea?
You can request a quote for N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea?
Yes, KEHONG BIO provides custom synthesis services for N,N-Diisopropyl-N'-isoamyl-N'-diethylaminoethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.