2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one
TL;DR: 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one (CAS 726201-08-7) is a chemical compound with molecular formula C18H16N4O and molecular weight 304.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-4H-pyrazol-3-one
Also Known As: ChemDiv3_015082, 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one, 2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-4H-pyrazol-3-one, 2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-2,4-dihydro-3H-pyrazol-3-one, 1-benzimidazol-2-yl-3-methyl-4-benzyl-2-pyrazolin-5-one
| Molecular Formula | C18H16N4O |
|---|---|
| Molecular Weight | 304.13 g/mol |
| LogP | 3.1443 |
| Topological Polar Surface Area | 61.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.13242 |
| Heavy Atoms | 23 |
| Complexity | 864.5403 |
Chemical Identifiers
| CAS Number | 726201-08-7 |
|---|---|
| SMILES | CC1=NN(C(=O)C1CC2=CC=CC=C2)C3=NC4=CC=CC=C4N3 |
Product Overview
2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one (CAS 726201-08-7), with molecular formula C18H16N4O and molecular weight 304.13 g/mol. IUPAC: 2-(1H-benzimidazol-2-yl)-4-benzyl-5-methyl-4H-pyrazol-3-one.
Chemical Property Profile of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one
Property Insights of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one
The XLogP value of 3.1443 indicates that 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.35 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-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 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one?
The CAS number of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one is 726201-08-7.
What is the molecular formula of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one?
The molecular formula of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one is C18H16N4O.
What is the molecular weight of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one?
The molecular weight of 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one is 304.13 g/mol.
Where can I buy 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one?
You can request a quote for 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-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-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-yl)-5-methyl-4-(phenylmethyl)-4H-pyrazol-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.