CAS 391876-34-9 - C20H19N3O2
TL;DR: CAS 391876-34-9 - C20H19N3O2 (CAS 391876-34-9) is a chemical compound with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-2-(1-methylbenzimidazol-2-yl)-3-(4-propan-2-yloxyphenyl)prop-2-enenitrile
Also Known As: 2-[(2E)-1-methyl-2,3-dihydro-1H-1,3-benzodiazol-2-ylidene]-3-oxo-3-[4-(propan-2-yloxy)phenyl]propanenitrile
| Molecular Formula | C20H19N3O2 |
|---|---|
| Molecular Weight | 333.15 g/mol |
| LogP | 4.31038 |
| Topological Polar Surface Area | 71.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 333.14774 |
| Heavy Atoms | 25 |
| Complexity | 976.33905 |
Chemical Identifiers
| CAS Number | 391876-34-9 |
|---|---|
| SMILES | CC(C)OC1=CC=C(C=C1)C(=C(C#N)C2=NC3=CC=CC=C3N2C)O |
Product Overview
CAS 391876-34-9 - C20H19N3O2 (CAS 391876-34-9), with molecular formula C20H19N3O2 and molecular weight 333.15 g/mol. IUPAC: 3-hydroxy-2-(1-methylbenzimidazol-2-yl)-3-(4-propan-2-yloxyphenyl)prop-2-enenitrile.
Chemical Property Profile of CAS 391876-34-9 - C20H19N3O2
Property Insights of CAS 391876-34-9 - C20H19N3O2
The XLogP value of 4.31038 indicates that CAS 391876-34-9 - C20H19N3O2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.07 Ų falls within the moderate polarity range, balancing permeability and solubility for CAS 391876-34-9 - C20H19N3O2. Following Lipinski's Rule of Five, CAS 391876-34-9 - C20H19N3O2 has 1 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 CAS 391876-34-9 - C20H19N3O2?
The CAS number of CAS 391876-34-9 - C20H19N3O2 is 391876-34-9.
What is the molecular formula of CAS 391876-34-9 - C20H19N3O2?
The molecular formula of CAS 391876-34-9 - C20H19N3O2 is C20H19N3O2.
What is the molecular weight of CAS 391876-34-9 - C20H19N3O2?
The molecular weight of CAS 391876-34-9 - C20H19N3O2 is 333.15 g/mol.
Where can I buy CAS 391876-34-9 - C20H19N3O2?
You can request a quote for CAS 391876-34-9 - C20H19N3O2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CAS 391876-34-9 - C20H19N3O2?
Yes, KEHONG BIO provides custom synthesis services for CAS 391876-34-9 - C20H19N3O2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.