Chem
J-GLOBAL ID:201707004042059550
Nikkaji number:J3.614.804G
eCF-506
N-[4-[4-アミノ-1-[2-[4-(ジメチルアミノ)ピペリジン-1-イル]エチル]-1H-ピラゾロ[3,4-d]ピリミジン-3-イル]-2-メトキシフェニル]カルバミド酸tert-ブチル
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C26 H38 N8 O3
Molecular formula furigana:
C26-H38-N8-O3
Molecular weight:
510.643
InChI:
InChI=1S/C26H38N8O3/c1-26(2,3)37-25(35)30-19-8-7-17(15-20(19)36-6)22-21-23(27)28-16-29-24(21)34(31-22)14-13-33-11-9-18(10-12-33)32(4)5/h7-8,15-16,18H,9-14H2,1-6H3,(H,30,35)(H2,27,28,29)
InChI key:
GMPQGWXPDRNCBL-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1NC(=O)OC(C)(C)C)c1nn(CCN2CCC(CC2)N(C)C)c2ncnc(N)c12
Systematic name (3):
N-[4-[4-アミノ-1-[2-[4-(ジメチルアミノ)ピペリジン-1-イル]エチル]-1H-ピラゾロ[3,4-d]ピリミジン-3-イル]-2-メトキシフェニル]カルバミド酸tert-ブチル
tert-ブチル N-[4-(4-アミノ-1-{2-[4-(ジメチルアミノ)ピペリジン-1-イル]エチル}-1H-ピラゾロ[3,4-d]ピリミジン-3-イル)-2-メトキシフェニル]カルバマート
tert-butyl N-[4-(4-amino-1-{2-[4-(dimethylamino)piperidin-1-yl]ethyl}-1H-pyrazolo[3,4-d]pyrimidin-3-yl)-2-methoxyphenyl]carbamate
Other name (2):
N-[4-[4-Amino-1-[2-[4-(dimethylamino)piperidine-1-yl]ethyl]-1H-pyrazolo[3,4-d]pyrimidine-3-yl]-2-methoxyphenyl]carbamic acid tert-butyl ester
eCF-506
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