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3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea
TL;DR: 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea (CAS 31563-40-3) is a chemical compound with molecular formula C16H34N4O2 and molecular weight 314.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[6-(diethylcarbamoylamino)hexyl]-1,1-diethylurea
Also Known As: 3-[6-(diethylcarbamoylamino)hexyl]-1,1-diethylurea, N',N''-Hexane-1,6-diylbis(N,N-diethylurea), 3,3'-HEXAMETHYLENEBIS(1,1-DIETHYLUREA)
| Molecular Formula | C16H34N4O2 |
|---|---|
| Molecular Weight | 314.27 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 64.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 314.2682 |
| Heavy Atoms | 22 |
| Complexity | 273.0 |
Chemical Identifiers
| CAS Number | 31563-40-3 |
|---|---|
| SMILES | CCN(CC)C(=O)NCCCCCCNC(=O)N(CC)CC |
| InChIKey | VJHDWPCXKVNNLE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea (CAS 31563-40-3), with molecular formula C16H34N4O2 and molecular weight 314.27 g/mol. IUPAC: 3-[6-(diethylcarbamoylamino)hexyl]-1,1-diethylurea.
Chemical Property Profile of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea
Property Insights of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea. The TPSA of 64.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea. Following Lipinski's Rule of Five, 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea 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 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea?
The CAS number of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea is 31563-40-3.
What is the molecular formula of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea?
The molecular formula of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea is C16H34N4O2.
What is the molecular weight of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea?
The molecular weight of 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea is 314.27 g/mol.
Where can I buy 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea?
You can request a quote for 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea?
Yes, KEHONG BIO provides custom synthesis services for 3-[6-(Diethylcarbamoylamino)hexyl]-1,1-diethylurea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.