1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
TL;DR: 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine (CAS 852840-17-6) is a chemical compound with molecular formula C15H18N4O3S and molecular weight 334.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
imidazol-1-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone
Also Known As: 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine, imidazol-1-yl-(4-tosylpiperazino)methanone, 1-(1H-imidazol-1-ylcarbonyl)-4-[(4-methylphenyl)sulfonyl]piperazine, imidazol-1-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone, 1-(imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
| Molecular Formula | C15H18N4O3S |
|---|---|
| Molecular Weight | 334.11 g/mol |
| LogP | 1.16612 |
| Topological Polar Surface Area | 75.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 334.10995 |
| Heavy Atoms | 23 |
| Complexity | 776.6393 |
Chemical Identifiers
| CAS Number | 852840-17-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3C=CN=C3 |
Product Overview
1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine (CAS 852840-17-6), with molecular formula C15H18N4O3S and molecular weight 334.11 g/mol. IUPAC: imidazol-1-yl-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]methanone.
Chemical Property Profile of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
Property Insights of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine
The XLogP value of 1.16612 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine. The TPSA of 75.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine. Following Lipinski's Rule of Five, 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine has 0 hydrogen bond donor(s) and 4 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-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The CAS number of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is 852840-17-6.
What is the molecular formula of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The molecular formula of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is C15H18N4O3S.
What is the molecular weight of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
The molecular weight of 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine is 334.11 g/mol.
Where can I buy 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
You can request a quote for 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-(1H-imidazole-1-carbonyl)-4-(4-methylbenzenesulfonyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.