| Identification | Back Directory | [Name]
XD14 | [CAS]
1370888-71-3 | [Synonyms]
XD14
CS-2672
XD 14;XD-14
4-Acetyl-N-[5-[(diethylamino)sulfonyl]-2-hydroxyphenyl]-3-ethyl-5-methyl-1H-pyrrole-2-carboxamide | [Molecular Formula]
C20H27N3O5S | [MDL Number]
MFCD23144071 | [MOL File]
1370888-71-3.mol | [Molecular Weight]
421.51 |
| Chemical Properties | Back Directory | [density ]
1.300±0.06 g/cm3(Predicted) | [form ]
Solid | [pka]
7.47±0.50(Predicted) | [color ]
Off-white to light yellow | [InChI]
InChI=1S/C20H27N3O5S/c1-6-15-18(13(5)24)12(4)21-19(15)20(26)22-16-11-14(9-10-17(16)25)29(27,28)23(7-2)8-3/h9-11,21,25H,6-8H2,1-5H3,(H,22,26) | [InChIKey]
DPBKLIVPNYGQQG-UHFFFAOYSA-N | [SMILES]
N1C(C)=C(C(C)=O)C(CC)=C1C(NC1=CC(S(N(CC)CC)(=O)=O)=CC=C1O)=O |
| Hazard Information | Back Directory | [Uses]
4-Acetyl-N-[5-[(diethylamino)sulfonyl]-2-hydroxyphenyl]-3-ethyl-5-methyl-1H-pyrrole-2-carboxamide is a bromodomain and extra-terminal (BET) inhibitor and exerts a strong inhibitory potential on the proliferation of specific leukemia cell lines. | [IC 50]
BRD2: 170 nM (Kd); BRD3: 380 nM (Kd); BRD4: 160 nM (Kd) |
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