4-[(3S)-4-[(S)-4-(Trifluoromethyl)-alpha-methylbenzyl]-3-methyl-piperazino]-4-methylpiperidino 4,6-dimethyl-5-pyrimidinyl ketone

• 常用名: 4-[(3S)-4-[(S)-4-(Trifluoromethyl)-alpha-methylbenzyl]-3-methyl-piperazino]-4-methylpiperidino 4,6-dimethyl-5-pyrimidinyl ketone
• 英文名: 4-[(3S)-4-[(S)-4-(Trifluoromethyl)-alpha-methylbenzyl]-3-methyl-piperazino]-4-methylpiperidino 4,6-dimethyl-5-pyrimidinyl ketone
• CAS号: 306296-62-8
• 分子量: 503.6
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₇H₃₆F₃N₅O
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 4-[(3S)-4-[(S)-4-(Trifluoromethyl)-alpha-methylbenzyl]-3-methyl-piperazino]-4-methylpiperidino 4,6-dimethyl-5-pyrimidinyl ketone

物理化学性质

• 分子式: C₂₇H₃₆F₃N₅O
• 分子量: 503.6
• InChIKey: HMBFXHIQISYDKM-RXVVDRJESA-N
• SMILES: C[C@H]1CN(CCN1[C@@H](C)C2=CC=C(C=C2)C(F)(F)F)C3(CCN(CC3)C(=O)C4=C(N=CN=C4C)C)C

靶点实验

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实验名称：Tested for inhibiting HIV (ADA) entry into cells 来源：ChEMBL 靶标：U-87 MG External Id：CHEMBL815086

实验名称：Ratio of AUCbrain to AUCplasma 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL624654

实验名称：HIV Enzyme Data 来源：NIAID 靶标：N/A External Id：HIV Enzyme Data

实验名称：Inhibition of RANTES binding to the human C-C chemokine receptor type 5 (CCR5) 来源：ChEMBL 靶标：C-C chemokine receptor type 5 External Id：CHEMBL649945

实验名称：Area under the curve for the compound calculated from 0-24 hr after intravenous admin... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL627906

实验名称：Area under the curve for the compound calculated from 0-24 hr after oral administrati... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL627907

实验名称：Half-life was calculated in rat 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL625281

实验名称：Area under the curve for the compound calculated from 0-6 hr after oral administratio... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL876783

实验名称：HIV Cellular Data 来源：NIAID 靶标：N/A External Id：HIV Cellular Data

实验名称：Oral bioavailability evaluated in rat 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL623054

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