![2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one structure](/static/products/577/577984-30-6.png)
2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one
TL;DR: 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one (CAS 577984-30-6) is a chemical compound with molecular formula C23H18N4O2S and molecular weight 414.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one
Also Known As: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one, 2-(((1H-benzo[d]imidazol-2-yl)methyl)thio)-3-(4-methoxyphenyl)quinazolin-4(3H)-one, 2-(1H-benzoimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one, 2-(benzimidazol-2-ylmethylthio)-3-(4-methoxyphenyl)-3-hydroquinazolin-4-one, 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one
| Molecular Formula | C23H18N4O2S |
|---|---|
| Molecular Weight | 414.12 g/mol |
| LogP | 4.5629 |
| Topological Polar Surface Area | 72.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 414.11505 |
| Heavy Atoms | 30 |
| Complexity | 1373.7151 |
Chemical Identifiers
| CAS Number | 577984-30-6 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC4=NC5=CC=CC=C5N4 |
Product Overview
2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one (CAS 577984-30-6), with molecular formula C23H18N4O2S and molecular weight 414.12 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylmethylsulfanyl)-3-(4-methoxyphenyl)quinazolin-4-one.
Chemical Property Profile of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one
Property Insights of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one
The XLogP value of 4.5629 indicates that 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one. Following Lipinski's Rule of Five, 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one has 1 hydrogen bond donor(s) and 5 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-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one?
The CAS number of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one is 577984-30-6.
What is the molecular formula of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one?
The molecular formula of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one is C23H18N4O2S.
What is the molecular weight of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one?
The molecular weight of 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one is 414.12 g/mol.
Where can I buy 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one?
You can request a quote for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-[(1H-benzimidazol-2-ylmethyl)sulfanyl]-3-(4-methoxyphenyl)quinazolin-4(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.