2-(4-(benzo[d]thiazol-2-yl)-1H-pyrazol-3-yl)-5-((4-nitrobenzyl)oxy)phenol
2-[4-(1,3-benzothiazol-2-yl)-1H-pyrazol-5-yl]-5-[(4-nitrophenyl)methoxy]phenol
Also Known As: Oprea1_433730|Oprea1_641057|SR-01000487946-1|2-(4-(benzo[d]thiazol-2-yl)-1H-pyrazol-3-yl)-5-((4-nitrobenzyl)oxy)phenol|2-[4-(1,3-benzothiazol-2-yl)-1H-pyrazol-3-yl]-5-[(4-nitrobenzyl)oxy]phenol|2-[4-(1,3-benzothiazol-2-yl)-1H-pyrazol-3-yl]-5-[(4-nitrophenyl)methoxy]phenol|(6Z)-6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one|6-[4-(1,3-benzothiazol-2-yl)-1,2-dihydropyrazol-3-ylidene]-3-[(4-nitrophenyl)methoxy]cyclohexa-2,4-dien-1-one
| Molecular Formula | C23H16N4O4S |
|---|---|
| Molecular Weight | 444.08923 g/mol |
| LogP | 5.5462 |
| Topological Polar Surface Area | 114.17 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 444.08923 |
| Monoisotopic Mass | 444.08923 |
| Heavy Atoms | 32 |
| Complexity | 1392.7593 |
Chemical Identifiers
| CAS Number | 302575-57-1 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(S2)C3=C(NN=C3)C4=C(C=C(C=C4)OCC5=CC=C(C=C5)[N+](=O)[O-])O |
Product Overview
2-(4-(benzo[d]thiazol-2-yl)-1H-pyrazol-3-yl)-5-((4-nitrobenzyl)oxy)phenol (CAS 302575-57-1), with molecular formula C23H16N4O4S and molecular weight 444.08923 g/mol. IUPAC: 2-[4-(1,3-benzothiazol-2-yl)-1H-pyrazol-5-yl]-5-[(4-nitrophenyl)methoxy]phenol.