产品名称

英文名称：MLN8054

同义词

MLN8054、869363-13-3、MLN-8054、MLN 8054、4-[[9-Chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid、4-((9-chloro-7-(2,6-difluorophenyl)-5H-benzo[c]pyrimido[4,5-e]azepin-2-yl)amino)benzoic acid、BX854EHD63、CHEMBL259084、4-(9-chl

产品性质

CAS编号：869363-13-3

分子式：C25H15ClF2N4O2

分子量：476.86

PubChem编号：11712649

英文别名：MLN8054|869363-13-3|MLN-8054|MLN 8054|4-[[9-Chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid|4-((9-chloro-7-(2,6-difluorophenyl)-5H-benzo[c]pyrimido[4,5-e]azepin-2-yl)amino)benzoic acid|BX854EHD63|CHEMBL259084|4-(9-chl

规格或纯度：≥97%

英文名称：MLN8054

生化机理：MLN8054 is an orally bioavailable, highly selective small molecule inhibitor of the serine/threonine protein kinase Aurora A kinase with potential antineoplastic activity.

储存温度：-20°C储存

运输条件：超低温冰袋运输

备注：卖完停产，不再备货

产品介绍：MLN8054是Aurora A 选择性抑制剂，IC50为4 nM。MLN8054 is a potent and selective inhibitor of Aurora A with IC50 of 4 nM in Sf9 insect cell. It is more than 40-fold selective for Aurora A than Aurora B.

ALogP：5.2

IUPAC Name：4-[[9-chloro-7-(2,6-difluorophenyl)-5H-pyrimido[5,4-d][2]benzazepin-2-yl]amino]benzoic acid

INCHI：InChI=1S/C25H15ClF2N4O2/c26-15-6-9-17-18(10-15)23(21-19(27)2-1-3-20(21)28)29-11-14-12-30-25(32-22(14)17)31-16-7-4-13(5-8-16)24(33)34/h1-10,12H,11H2,(H,33,34)(H,30,31,32)

InChi Key：HHFBDROWDBDFBR-UHFFFAOYSA-N

Canonical SMILES：C1C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)C(=N1)C4=C(C=CC=C4F)F)NC5=CC=C(C=C5)C(=O)O

Isomeric SMILES：C1C2=CN=C(N=C2C3=C(C=C(C=C3)Cl)C(=N1)C4=C(C=CC=C4F)F)NC5=CC=C(C=C5)C(=O)O

PubChem CID：11712649

CAS Registry No.：869363-13-3

DiscoveRx TREEspot：MLN-8054|

ChEMBL Ligand：CHEMBL259084

RCSB PDB Ligand：ZZL

溶解性：DMSO 95 mg/mL Water <1 mg/mL Ethanol <1 mg/mL

产品包装