2-amino-5-benzylidene-1-methylimidazol-4-one
TL;DR: 2-amino-5-benzylidene-1-methylimidazol-4-one (CAS 6964-11-0) is a chemical compound with molecular formula C11H11N3O and molecular weight 201.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-5-benzylidene-1-methylimidazol-4-one
Also Known As: 2-amino-5-benzylidene-1-methylimidazol-4-one, 5-Benzylidene-2-imino-1-methyl-4-imidazolidinone, 2-amino-1-methyl-5-(phenylmethylidene)-4,5-dihydro-1H-imidazol-4-one, 4H-Imidazol-4-one,2-amino-1,5-dihydro-1-methyl-5-(phenylmethylene)-
| Molecular Formula | C11H11N3O |
|---|---|
| Molecular Weight | 201.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 58.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.09021 |
| Heavy Atoms | 15 |
| Complexity | 327.0 |
Chemical Identifiers
| CAS Number | 6964-11-0 |
|---|---|
| SMILES | CN1C(=CC2=CC=CC=C2)C(=O)N=C1N |
| InChIKey | NTICHQNQVDSJAT-UHFFFAOYSA-N |
Product Overview
2-amino-5-benzylidene-1-methylimidazol-4-one (CAS 6964-11-0), with molecular formula C11H11N3O and molecular weight 201.09 g/mol. IUPAC: 2-amino-5-benzylidene-1-methylimidazol-4-one.
Chemical Property Profile of 2-amino-5-benzylidene-1-methylimidazol-4-one
Property Insights of 2-amino-5-benzylidene-1-methylimidazol-4-one
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-amino-5-benzylidene-1-methylimidazol-4-one. With a topological polar surface area (TPSA) of 58.7 Ų, 2-amino-5-benzylidene-1-methylimidazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-amino-5-benzylidene-1-methylimidazol-4-one has 1 hydrogen bond donor(s) and 1 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 2-amino-5-benzylidene-1-methylimidazol-4-one?
The CAS number of 2-amino-5-benzylidene-1-methylimidazol-4-one is 6964-11-0.
What is the molecular formula of 2-amino-5-benzylidene-1-methylimidazol-4-one?
The molecular formula of 2-amino-5-benzylidene-1-methylimidazol-4-one is C11H11N3O.
What is the molecular weight of 2-amino-5-benzylidene-1-methylimidazol-4-one?
The molecular weight of 2-amino-5-benzylidene-1-methylimidazol-4-one is 201.09 g/mol.
Where can I buy 2-amino-5-benzylidene-1-methylimidazol-4-one?
You can request a quote for 2-amino-5-benzylidene-1-methylimidazol-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-amino-5-benzylidene-1-methylimidazol-4-one?
Yes, KEHONG BIO provides custom synthesis services for 2-amino-5-benzylidene-1-methylimidazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.