![N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea structure](/static/products/791/791794-48-4.png)
N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea
TL;DR: N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea (CAS 791794-48-4) is a chemical compound with molecular formula C16H24N4O3S2 and molecular weight 384.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide
Also Known As: AN-329/42613614, N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea, 2-methyl-N-[({4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}amino)carbonothioyl]propanamide, 2-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide, 2-methyl-N-({4-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}carbamothioyl)propanamide
| Molecular Formula | C16H24N4O3S2 |
|---|---|
| Molecular Weight | 384.13 g/mol |
| LogP | 1.0917 |
| Topological Polar Surface Area | 81.75 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 384.129 |
| Heavy Atoms | 25 |
| Complexity | 724.25165 |
Chemical Identifiers
| CAS Number | 791794-48-4 |
|---|---|
| SMILES | CC(C)C(=O)NC(=S)NC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C |
Product Overview
N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea (CAS 791794-48-4), with molecular formula C16H24N4O3S2 and molecular weight 384.13 g/mol. IUPAC: 2-methyl-N-[[4-(4-methylpiperazin-1-yl)sulfonylphenyl]carbamothioyl]propanamide.
Chemical Property Profile of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea
Property Insights of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea
The XLogP value of 1.0917 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea. The TPSA of 81.75 Ų falls within the moderate polarity range, balancing permeability and solubility for N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea. Following Lipinski's Rule of Five, N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea has 2 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 N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea?
The CAS number of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea is 791794-48-4.
What is the molecular formula of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea?
The molecular formula of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea is C16H24N4O3S2.
What is the molecular weight of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea?
The molecular weight of N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea is 384.13 g/mol.
Where can I buy N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea?
You can request a quote for N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-isobutyryl-N'-{4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl}thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.