![(6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one structure](/static/products/123/123990-43-2.png)
(6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one
TL;DR: (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one (CAS 123990-43-2) is a chemical compound with molecular formula C22H17N3O and molecular weight 339.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-phenyl-3,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)phenol
Also Known As: (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one, 2-(4-phenyl-3,4-dihydrobenzo[4,5]imidazo[1,2-a]pyrimidin-2-yl)phenol, 2-(4-phenyl-3,4-dihydropyrimido[1,2-a]benzimidazol-1-ium-2-yl)phenolate, 6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one, (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)-1-cyclohexa-2,4-dienone
| Molecular Formula | C22H17N3O |
|---|---|
| Molecular Weight | 339.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 50.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.13718 |
| Heavy Atoms | 26 |
| Complexity | 529.0 |
Chemical Identifiers
| CAS Number | 123990-43-2 |
|---|---|
| SMILES | C1C(N2C3=CC=CC=C3N=C2N=C1C4=CC=CC=C4O)C5=CC=CC=C5 |
| InChIKey | ANQWQLGUIIXYDF-UHFFFAOYSA-N |
Product Overview
(6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one (CAS 123990-43-2), with molecular formula C22H17N3O and molecular weight 339.14 g/mol. IUPAC: 2-(4-phenyl-3,4-dihydropyrimido[1,2-a]benzimidazol-2-yl)phenol.
Chemical Property Profile of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one
Property Insights of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one
The XLogP value of 4.2 indicates that (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.4 Ų, (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one has 1 hydrogen bond donor(s) and 3 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 (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one?
The CAS number of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one is 123990-43-2.
What is the molecular formula of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one?
The molecular formula of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one is C22H17N3O.
What is the molecular weight of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one?
The molecular weight of (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one is 339.14 g/mol.
Where can I buy (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one?
You can request a quote for (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one?
Yes, KEHONG BIO provides custom synthesis services for (6E)-6-(4-phenyl-3,4-dihydro-1H-pyrimido[1,2-a]benzimidazol-2-ylidene)cyclohexa-2,4-dien-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.