N-((4-(4-acetylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxy-3-nitrobenzamide
N-[[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide
Also Known As: SR-01000772836-2|1-[4-(4-Acetyl-piperazin-1-yl)-phenyl]-3-(4-methoxy-3-nitro-benzoyl)-thiourea|N-((4-(4-acetylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxy-3-nitrobenzamide|N-({[4-(4-acetylpiperazinyl)phenyl]amino}thioxomethyl)(4-methoxy-3-nitrophenyl )carboxamide|N-[[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide|N-{[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl}-4-methoxy-3-nitrobenzamide
| Molecular Formula | C21H23N5O5S |
|---|---|
| Molecular Weight | 457.142 g/mol |
| LogP | 2.3987 |
| Topological Polar Surface Area | 117.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 457.142 |
| Monoisotopic Mass | 457.142 |
| Heavy Atoms | 32 |
| Complexity | 1035.376 |
Chemical Identifiers
| CAS Number | 688012-45-5 |
|---|---|
| SMILES | CC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-] |
Product Overview
N-((4-(4-acetylpiperazin-1-yl)phenyl)carbamothioyl)-4-methoxy-3-nitrobenzamide (CAS 688012-45-5), with molecular formula C21H23N5O5S and molecular weight 457.142 g/mol. IUPAC: N-[[4-(4-acetylpiperazin-1-yl)phenyl]carbamothioyl]-4-methoxy-3-nitrobenzamide.