4,4′-Bis(1-phenyl-3-methyl-5-pyrazolone)
Properties
- Molecular formula
- C20H18N4O2
- Molar mass
- 346.39 g/mol
- Exact mass
- 346.1430 Da
- Melting point
- above 320 °C
- logP
- 3.06Crippen estimate
- Polar surface area
- 65.3 Ų
- H-bond donors / acceptors
- 0 / 4
- Rotatable bonds
- 3
Identifiers
CAS number
7477-67-0SMILES
CC1=NN(c2ccccc2)C(=O)C1C1C(=O)N(c2ccccc2)N=C1CInChIKey
FORCWSNQDMPPOC-UHFFFAOYSA-NInChI
InChI=1S/C20H18N4O2/c1-13-17(19(25)23(21-13)15-9-5-3-6-10-15)18-14(2)22-24(20(18)26)16-11-7-4-8-12-16/h3-12,17-18H,1-2H3Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
6 names
- [4,4′-Bi-3H-pyrazole]-3,3′-dione, 2,2′,4,4′-tetrahydro-5,5′-dimethyl-2,2′-diphenyl-
- [4,4′-Bi-2-pyrazoline]-5,5′-dione, 3,3′-dimethyl-1,1′-diphenyl-
- 2,2′,4,4′-Tetrahydro-5,5′-dimethyl-2,2′-diphenyl[4,4′-bi-3H-pyrazole]-3,3′-dione
- NSC 37393
- NSC 401001
- 3-Methyl-4-(3-methyl-5-oxo-1-phenyl-4,5-dihydro-1H-pyrazol-4-yl)-1-phenyl-4,5-dihydro-1H-pyrazol-5-one
Work with 4,4′-Bis(1-phenyl-3-methyl-5-pyrazolone)
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Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds