1,3-Bis[3-(dimethylamino)propyl]urea
TL;DR: 1,3-Bis[3-(dimethylamino)propyl]urea (CAS 52338-87-1) is a chemical compound with molecular formula C11H26N4O and molecular weight 230.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-bis[3-(dimethylamino)propyl]urea
Also Known As: 1,3-bis[3-(dimethylamino)propyl]urea, 1,3-Bis(3-(dimethylamino)propyl)urea, Urea, N,N'-bis[3-(dimethylamino)propyl]-, 1,3-bis(dimethylaminopropyl)urea, N,N'-Bis(3-(dimethylamino)propyl)urea
| Molecular Formula | C11H26N4O |
|---|---|
| Molecular Weight | 230.21 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 230.21066 |
| Heavy Atoms | 16 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 52338-87-1 |
|---|---|
| SMILES | CN(C)CCCNC(=O)NCCCN(C)C |
| InChIKey | FCQPNTOQFPJCMF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3-Bis[3-(dimethylamino)propyl]urea (CAS 52338-87-1), with molecular formula C11H26N4O and molecular weight 230.21 g/mol. IUPAC: 1,3-bis[3-(dimethylamino)propyl]urea.
Chemical Property Profile of 1,3-Bis[3-(dimethylamino)propyl]urea
Property Insights of 1,3-Bis[3-(dimethylamino)propyl]urea
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Bis[3-(dimethylamino)propyl]urea. With a topological polar surface area (TPSA) of 47.6 Ų, 1,3-Bis[3-(dimethylamino)propyl]urea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Bis[3-(dimethylamino)propyl]urea has 2 hydrogen bond donor(s) and 3 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 1,3-Bis[3-(dimethylamino)propyl]urea?
The CAS number of 1,3-Bis[3-(dimethylamino)propyl]urea is 52338-87-1.
What is the molecular formula of 1,3-Bis[3-(dimethylamino)propyl]urea?
The molecular formula of 1,3-Bis[3-(dimethylamino)propyl]urea is C11H26N4O.
What is the molecular weight of 1,3-Bis[3-(dimethylamino)propyl]urea?
The molecular weight of 1,3-Bis[3-(dimethylamino)propyl]urea is 230.21 g/mol.
Where can I buy 1,3-Bis[3-(dimethylamino)propyl]urea?
You can request a quote for 1,3-Bis[3-(dimethylamino)propyl]urea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Bis[3-(dimethylamino)propyl]urea?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Bis[3-(dimethylamino)propyl]urea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.