AC1NV2HY
dimethyl 2-[1-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]ethylideneamino]benzene-1,4-dicarboxylate
Also Known As: SR-01000501184-1|dimethyl 2-({(1E)-1-[1-(1,3-benzothiazol-2-yl)-5-hydroxy-3-methyl-1H-pyrazol-4-yl]ethylidene}amino)benzene-1,4-dicarboxylate|(Z)-dimethyl 2-((1-(1-(benzo[d]thiazol-2-yl)-3-methyl-5-oxo-1H-pyrazol-4(5H)-ylidene)ethyl)amino)terephthalate|1,4-DIMETHYL 2-({1-[(4Z)-1-(1,3-BENZOTHIAZOL-2-YL)-3-METHYL-5-OXO-4,5-DIHYDRO-1H-PYRAZOL-4-YLIDENE]ETHYL}AMINO)BENZENE-1,4-DICARBOXYLATE|dimethyl 2-({(1Z)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]ethyl}amino)benzene-1,4-dicarboxylate|dimethyl 2-[[(1Z)-1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxopyrazol-4-ylidene]ethyl]amino]benzene-1,4-dicarboxylate|dimethyl 2-[1-[1-(1,3-benzothiazol-2-yl)-3-methyl-5-oxopyrazol-4-ylidene]ethylamino]benzene-1,4-dicarboxylate|methyl 3-{[(1-benzothiazol-2-yl-3-methyl-5-oxo(1,2-diazolin-4-ylidene))ethyl]a mino}-4-(methoxycarbonyl)benzoate
| Molecular Formula | C23H20N4O5S |
|---|---|
| Molecular Weight | 464.11545 g/mol |
| LogP | 3.79762 |
| Topological Polar Surface Area | 115.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 464.11545 |
| Monoisotopic Mass | 464.11545 |
| Heavy Atoms | 33 |
| Complexity | 1444.7721 |
Chemical Identifiers
| CAS Number | 433236-59-0 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=NC3=CC=CC=C3S2)C(=NC4=C(C=CC(=C4)C(=O)OC)C(=O)OC)C |
Product Overview
AC1NV2HY (CAS 433236-59-0), with molecular formula C23H20N4O5S and molecular weight 464.11545 g/mol. IUPAC: dimethyl 2-[1-[2-(1,3-benzothiazol-2-yl)-5-methyl-3-oxo-1H-pyrazol-4-yl]ethylideneamino]benzene-1,4-dicarboxylate.
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