![4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide structure](/static/products/876/87610-91-1.png)
4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide
TL;DR: 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide (CAS 87610-91-1) is a chemical compound with molecular formula C17H19ClN6OS and molecular weight 390.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide
Also Known As: 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide, 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methyls, 4-(4-Chlorophenyl)-N'-(2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl)-5-oxo-2,5-dihydro-1H-pyrazole-1-carboximidamide
| Molecular Formula | C17H19ClN6OS |
|---|---|
| Molecular Weight | 390.10 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 390.10297 |
| Heavy Atoms | 26 |
| Complexity | 563.0 |
Chemical Identifiers
| CAS Number | 87610-91-1 |
|---|---|
| SMILES | CC1=C(N=CN1)CSCCN=C(N)N2C(=O)C(=CN2)C3=CC=C(C=C3)Cl |
| InChIKey | ALWOQYSCXLJAJF-UHFFFAOYSA-N |
Product Overview
4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide (CAS 87610-91-1), with molecular formula C17H19ClN6OS and molecular weight 390.10 g/mol. IUPAC: 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide.
Chemical Property Profile of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide
Property Insights of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide. Following Lipinski's Rule of Five, 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide has 3 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 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide?
The CAS number of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide is 87610-91-1.
What is the molecular formula of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide?
The molecular formula of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide is C17H19ClN6OS.
What is the molecular weight of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide?
The molecular weight of 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide is 390.10 g/mol.
Where can I buy 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide?
You can request a quote for 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-chlorophenyl)-N'-[2-[(5-methyl-1H-imidazol-4-yl)methylsulfanyl]ethyl]-3-oxo-1H-pyrazole-2-carboximidamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.