N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide
N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide
Also Known As: Oprea1_758562|BAS 02760402|AG-690/15429189|N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide|N-{4-nitrobenzoyl}-N'-[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]thiourea|1-[2-(3-Methoxy-phenyl)-benzooxazol-5-yl]-3-(4-nitro-benzoyl)-thiourea|N-({[2-(3-methoxyphenyl)benzoxazol-5-yl]amino}thioxomethyl)(4-nitrophenyl)carb oxamide
| Molecular Formula | C22H16N4O5S |
|---|---|
| Molecular Weight | 448.08414 g/mol |
| LogP | 4.5384 |
| Topological Polar Surface Area | 119.53 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 448.08414 |
| Monoisotopic Mass | 448.08414 |
| Heavy Atoms | 32 |
| Complexity | 1333.9211 |
Chemical Identifiers
| CAS Number | 6311-75-7 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-] |
Product Overview
N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide (CAS 6311-75-7), with molecular formula C22H16N4O5S and molecular weight 448.08414 g/mol. IUPAC: N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide.
N-[[2-(3-methoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]-4-nitrobenzamide is a custom synthesis product. We offer services from milligram to kilogram scale.
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