![N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide structure](/static/products/577/577790-75-1.png)
N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide
TL;DR: N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide (CAS 577790-75-1) is a chemical compound with molecular formula C22H28N4O2S and molecular weight 412.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-3-propan-2-yloxybenzamide
Also Known As: 1-(3-Isopropoxy-benzoyl)-3-[4-(4-methyl-piperazin-1-yl)-phenyl]-thiourea, 3-isopropoxy-N-((4-(4-methylpiperazin-1-yl)phenyl)carbamothioyl)benzamide, N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-3-propan-2-yloxybenzamide, N-[[4-(4-methylpiperazin-1-yl)phenyl]thiocarbamoyl]-3-propan-2-yloxy-benzamide, N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide
| Molecular Formula | C22H28N4O2S |
|---|---|
| Molecular Weight | 412.19 g/mol |
| LogP | 3.3524 |
| Topological Polar Surface Area | 56.84 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 412.1933 |
| Heavy Atoms | 29 |
| Complexity | 846.1457 |
Chemical Identifiers
| CAS Number | 577790-75-1 |
|---|---|
| SMILES | CC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCN(CC3)C |
Product Overview
N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide (CAS 577790-75-1), with molecular formula C22H28N4O2S and molecular weight 412.19 g/mol. IUPAC: N-[[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]-3-propan-2-yloxybenzamide.
Chemical Property Profile of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide
Property Insights of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide
The XLogP value of 3.3524 indicates that N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.84 Ų, N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide 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-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide?
The CAS number of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide is 577790-75-1.
What is the molecular formula of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide?
The molecular formula of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide is C22H28N4O2S.
What is the molecular weight of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide?
The molecular weight of N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide is 412.19 g/mol.
Where can I buy N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide?
You can request a quote for N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide?
Yes, KEHONG BIO provides custom synthesis services for N-{[4-(4-methylpiperazin-1-yl)phenyl]carbamothioyl}-3-(propan-2-yloxy)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.