(αS)-N-(5-Cyclopropyl-1H-pyrazol-3-yl)-α-(1-methylethyl)-3-[6-[[(2E)-4-(4-mor...
C30H36N6O3
2768774-66-7 Copyright (C) 2025 ACS
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M  END
> <cas.rn>
2768774-66-7

> <ca.index.name>
Benzeneacetamide, N-(5-cyclopropyl-1H-pyrazol-3-yl)-α-(1-methylethyl)-3-[6-[[(2E)-4-(4-morpholinyl)-1-oxo-2-buten-1-yl]amino]-3-pyridinyl]-, (αS)-

> <molecular.formula>
C30H36N6O3

> <smiles.canonical>
O=C(C=CCN1CCOCC1)NC=2N=CC(=CC2)C3=CC=CC(=C3)C(C(=O)NC4=NNC(=C4)C5CC5)C(C)C

> <smiles.isomeric>
[C@H](C(NC=1C=C(NN1)C2CC2)=O)(C(C)C)C3=CC(=CC=C3)C=4C=CC(NC(/C=C/CN5CCOCC5)=O)=NC4

> <molecular.weight>
528.65

> <boiling.point.predicted>
840.808±65.00 °C    Press: 760.00 Torr

> <density.predicted>
1.270±0.06 g/cm3    Temp: 25 °C; Press: 760 Torr

> <pka.predicted>
9.316±0.46    Most Acidic Temp: 25 °C

$$$$
