3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one
TL;DR: 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one (CAS 611-44-9) is a chemical compound with molecular formula C12H9N3O and molecular weight 211.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3Z)-3-(1H-imidazol-5-ylmethylidene)-1H-indol-2-one
Also Known As: Tripolin B, Angiogenesis Inhibitor, Angiostatic Agent, Angiostatic Agents, Agent, Angiostatic
| Molecular Formula | C12H9N3O |
|---|---|
| Molecular Weight | 211.07 g/mol |
| LogP | 1.9024 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.07455 |
| Heavy Atoms | 16 |
| Complexity | 569.70966 |
Chemical Identifiers
| CAS Number | 611-44-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)/C(=C/C3=CN=CN3)/C(=O)N2 |
Product Overview
3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one (CAS 611-44-9), with molecular formula C12H9N3O and molecular weight 211.07 g/mol. IUPAC: (3Z)-3-(1H-imidazol-5-ylmethylidene)-1H-indol-2-one.
Chemical Property Profile of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one
Property Insights of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one
The XLogP value of 1.9024 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one. With a topological polar surface area (TPSA) of 57.78 Ų, 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one 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-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one?
The CAS number of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one is 611-44-9.
What is the molecular formula of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one?
The molecular formula of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one is C12H9N3O.
What is the molecular weight of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one?
The molecular weight of 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one is 211.07 g/mol.
Where can I buy 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one?
You can request a quote for 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-imidazol-5-ylmethylene)-1,3-dihydro-2H-indol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.