AC1MH3LG
methyl 2-[4-[[4-(oxolane-2-carbonyl)piperazine-1-carbothioyl]amino]phenyl]acetate
Also Known As: VU0048157-1|SR-01000268455-1|methyl [4-({[4-(tetrahydrofuran-2-ylcarbonyl)piperazin-1-yl]carbonothioyl}amino)phenyl]acetate|methyl 2-(4-(4-(tetrahydrofuran-2-carbonyl)piperazine-1-carbothioamido)phenyl)acetate|methyl 2-[4-({[4-(oxolan-2-ylcarbonyl)piperazinyl]thioxomethyl}amino)phenyl]ac etate|methyl 2-[4-[[4-(oxolane-2-carbonyl)piperazine-1-carbothioyl]amino]phenyl]acetate
| Molecular Formula | C19H25N3O4S |
|---|---|
| Molecular Weight | 391.1566 g/mol |
| LogP | 1.4221 |
| Topological Polar Surface Area | 71.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 391.1566 |
| Monoisotopic Mass | 391.1566 |
| Heavy Atoms | 27 |
| Complexity | 680.70013 |
Chemical Identifiers
| CAS Number | 516458-55-2 |
|---|---|
| SMILES | COC(=O)CC1=CC=C(C=C1)NC(=S)N2CCN(CC2)C(=O)C3CCCO3 |
Product Overview
AC1MH3LG (CAS 516458-55-2), with molecular formula C19H25N3O4S and molecular weight 391.1566 g/mol. IUPAC: methyl 2-[4-[[4-(oxolane-2-carbonyl)piperazine-1-carbothioyl]amino]phenyl]acetate.
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