![2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol structure](/static/products/894/894209-30-4.png)
2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol
TL;DR: 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol (CAS 894209-30-4) is a chemical compound with molecular formula C18H15N3OS and molecular weight 321.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one
Also Known As: 2-((p-tolylthio)methyl)benzo[4,5]imidazo[1,2-a]pyrimidin-4(1H)-one, 2-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one, 2-{[(4-methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol, 2-{[(4-methylphenyl)thio]methyl}pyrimido[1,2-a]benzimidazol-4(1H)-one
| Molecular Formula | C18H15N3OS |
|---|---|
| Molecular Weight | 321.09 g/mol |
| LogP | 3.77652 |
| Topological Polar Surface Area | 50.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 321.0936 |
| Heavy Atoms | 23 |
| Complexity | 1047.4347 |
Chemical Identifiers
| CAS Number | 894209-30-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)SCC2=CC(=O)N3C4=CC=CC=C4N=C3N2 |
Product Overview
2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol (CAS 894209-30-4), with molecular formula C18H15N3OS and molecular weight 321.09 g/mol. IUPAC: 2-[(4-methylphenyl)sulfanylmethyl]-1H-pyrimido[1,2-a]benzimidazol-4-one.
Chemical Property Profile of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol
Property Insights of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol
The XLogP value of 3.77652 indicates that 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.16 Ų, 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol 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 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol?
The CAS number of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol is 894209-30-4.
What is the molecular formula of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol?
The molecular formula of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol is C18H15N3OS.
What is the molecular weight of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol?
The molecular weight of 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol is 321.09 g/mol.
Where can I buy 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol?
You can request a quote for 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(4-Methylphenyl)sulfanyl]methyl}pyrimido[1,2-a]benzimidazol-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.