Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-
TL;DR: Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- (CAS 4965-21-3) is a chemical compound with molecular formula C16H27N3O3 and molecular weight 309.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-3-ethylurea
Also Known As: 3-Chloro-6-methoxy (1H)indazole, N-(4-(3-((1,1-Dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethylurea, 1-ethyl-3-[4-[2-hydroxy-3- propoxy]phenyl]urea, 1-{4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl}-3-ethylurea, Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-
| Molecular Formula | C16H27N3O3 |
|---|---|
| Molecular Weight | 309.21 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 82.6 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 309.20523 |
| Heavy Atoms | 22 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 4965-21-3 |
|---|---|
| SMILES | CCNC(=O)NC1=CC=C(C=C1)OCC(CNC(C)(C)C)O |
| InChIKey | ZGESGEQWQQQWGH-UHFFFAOYSA-N |
Product Overview
Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- (CAS 4965-21-3), with molecular formula C16H27N3O3 and molecular weight 309.21 g/mol. IUPAC: 1-[4-[3-(tert-butylamino)-2-hydroxypropoxy]phenyl]-3-ethylurea.
Chemical Property Profile of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-
Property Insights of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-. The TPSA of 82.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-. Following Lipinski's Rule of Five, Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- has 4 hydrogen bond donor(s) and 4 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 Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-?
The CAS number of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- is 4965-21-3.
What is the molecular formula of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-?
The molecular formula of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- is C16H27N3O3.
What is the molecular weight of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-?
The molecular weight of Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- is 309.21 g/mol.
Where can I buy Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-?
You can request a quote for Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Urea, N-(4-(3-((1,1-dimethylethyl)amino)-2-hydroxypropoxy)phenyl)-N'-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.