VU0359595

Catalog NumberBL-M000582
CAS Number1246303-14-9
DescriptionVU0359595 is an inhibitor of Phospholipase D1 (PLD1) (IC50 = 3.7 nM) exhibiting >1,700-fold selectivity for PLD1 over PLD2 (IC50 = 6.4 μM). It may function via interacting with an allosteric site of PLD.
IUPAC Name(1R,2R)-N-[(2S)-1-[4-(5-bromo-2-oxo-3H-benzimidazol-1-yl)piperidin-1-yl]propan-2-yl]-2-phenylcyclopropane-1-carboxamide
SynonymsCID-53361951; ML-270; (1R,2R)-N-([S]-1-{4-[5-bromo-2-oxo-2,3-dihydro-1H-benzo(d)imidazol-1-yl]piperidin-1-yl}propan-2-yl)-2-phenylcyclopropanecarboxamide
Molecular Weight497.43
Molecular FormulaC25H29BrN4O2
Purity≥95%
Density1.395±0.06 g/cm3(Predicted)
SolubilitySoluble in DMSO (5 mg/ml)
AppearanceWhite to Beige Powder
Shelf Life1 Year
StorageStore at -20°C
Percent CompositionC 60.36%, H 5.88%, Br 16.06%, N 11.26%, O 6.43%
Canonical SMILESCC(CN1CCC(CC1)N2C3=C(C=C(C=C3)Br)NC2=O)NC(=O)C4CC4C5=CC=CC=C5
InChIInChI=1S/C25H29BrN4O2/c1-16(27-24(31)21-14-20(21)17-5-3-2-4-6-17)15-29-11-9-19(10-12-29)30-23-8-7-18(26)13-22(23)28-25(30)32/h2-8,13,16,19-21H,9-12,14-15H2,1H3,(H,27,31)(H,28,32)/t16-,20-,21+/m0/s1
InChI KeyJSVNNLRZCJAYTQ-ORYQWCPZSA-N

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