1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-
TL;DR: 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- (CAS 164295-91-4) is a chemical compound with molecular formula C11H10N4OS and molecular weight 246.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-1,2-dihydropyrazol-3-one
Also Known As: 4-benzimidazol-2-ylthio-3-methyl-3-pyrazolin-5-one, 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-, 4-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-1,2-dihydropyrazol-3-one, 4-(1H-1,3-benzodiazol-2-ylsulfanyl)-5-methyl-2,3-dihydro-1H-pyrazol-3-one
| Molecular Formula | C11H10N4OS |
|---|---|
| Molecular Weight | 246.06 g/mol |
| LogP | 2.03892 |
| Topological Polar Surface Area | 77.33 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 246.05753 |
| Heavy Atoms | 17 |
| Complexity | 691.22894 |
Chemical Identifiers
| CAS Number | 164295-91-4 |
|---|---|
| SMILES | CC1=C(C(=O)NN1)SC2=NC3=CC=CC=C3N2 |
Product Overview
1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- (CAS 164295-91-4), with molecular formula C11H10N4OS and molecular weight 246.06 g/mol. IUPAC: 4-(1H-benzimidazol-2-ylsulfanyl)-5-methyl-1,2-dihydropyrazol-3-one.
Chemical Property Profile of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-
Property Insights of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-
The XLogP value of 2.03892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-. The TPSA of 77.33 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-. Following Lipinski's Rule of Five, 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- has 3 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 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-?
The CAS number of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- is 164295-91-4.
What is the molecular formula of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-?
The molecular formula of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- is C11H10N4OS.
What is the molecular weight of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-?
The molecular weight of 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- is 246.06 g/mol.
Where can I buy 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-?
You can request a quote for 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl-?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dihydropyrazol-3-one, 4-(1H-benzoimidazol-2-ylsulfanyl)-5-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.