Ici 119033
TL;DR: Ici 119033 (CAS 70636-54-3) is a chemical compound with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-3-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]urea
Also Known As: Ici 119033, Ici 119,033, 1-benzyl-3-(2-{[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino}ethyl)urea, Urea, N-(2-((2-hydroxy-3-(4-hydroxyphenoxy)propyl)amino)ethyl)-N'-(phenylmethyl)-, (+-)-, 1-benzyl-3-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]urea
| Molecular Formula | C19H25N3O4 |
|---|---|
| Molecular Weight | 359.18 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 359.1845 |
| Heavy Atoms | 26 |
| Complexity | 383.0 |
Chemical Identifiers
| CAS Number | 70636-54-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)NCCNCC(COC2=CC=C(C=C2)O)O |
| InChIKey | JBORCKKRBVEGMN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ici 119033 (CAS 70636-54-3), with molecular formula C19H25N3O4 and molecular weight 359.18 g/mol. IUPAC: 1-benzyl-3-[2-[[2-hydroxy-3-(4-hydroxyphenoxy)propyl]amino]ethyl]urea.
Chemical Property Profile of Ici 119033
Property Insights of Ici 119033
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ici 119033. The TPSA of 103.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ici 119033. Following Lipinski's Rule of Five, Ici 119033 has 5 hydrogen bond donor(s) and 5 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 Ici 119033?
The CAS number of Ici 119033 is 70636-54-3.
What is the molecular formula of Ici 119033?
The molecular formula of Ici 119033 is C19H25N3O4.
What is the molecular weight of Ici 119033?
The molecular weight of Ici 119033 is 359.18 g/mol.
Where can I buy Ici 119033?
You can request a quote for Ici 119033 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ici 119033?
Yes, KEHONG BIO provides custom synthesis services for Ici 119033 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.