Name: PROTAC BTK Degrader-11
Brand: BOC Sciences
Rating: 5 (1 reviews)

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IUPACName

3-tert-butyl-N-[(1R)-1-[4-[6-[6-[4-[[1-[4-(2,6-dioxopiperidin-3-yl)phenyl]piperidin-4-yl]methyl]piperazin-1-yl]pyridin-3-yl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-2-methylphenyl]ethyl]-1,2,4-oxadiazole-5-carboxamide

Synonyms

1,2,4-Oxadiazole-5-carboxamide, 3-(1,1-dimethylethyl)-N-[(1R)-1-[4-[6-[6-[4-[[1-[4-(2,6-dioxo-3-piperidinyl)phenyl]-4-; piperidinyl]methyl]-1-piperazinyl]-3-pyridinyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-2-methylphenyl]ethyl]-

Density

1.265±0.06 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

InChI Key

UZDXDTMDMLTEJR-XNAWBMTISA-N

InChI

InChI=1S/C48H55N11O4/c1-29-24-33(8-12-36(29)30(2)52-45(62)46-55-47(56-63-46)48(3,4)5)42-38-25-39(53-43(38)51-28-50-42)34-9-14-40(49-26-34)59-22-20-57(21-23-59)27-31-16-18-58(19-17-31)35-10-6-32(7-11-35)37-13-15-41(60)54-44(37)61/h6-12,14,24-26,28,30-31,37H,13,15-23,27H2,1-5H3,(H,52,62)(H,50,51,53)(H,54,60,61)/t30-,37?/m1/s1

Canonical SMILES

CC1=C(C=CC(=C1)C2=C3C=C(NC3=NC=N2)C4=CN=C(C=C4)N5CCN(CC5)CC6CCN(CC6)C7=CC=C(C=C7)C8CCC(=O)NC8=O)[C@@H](C)NC(=O)C9=NC(=NO9)C(C)(C)C

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Desired final volume: *

Desired concentration: *

* Our calculator is based on the following equation:
Concentration (start) x Volume (start) = Concentration (final) x Volume (final)
It is commonly abbreviated as: C₁V₁ = C₂V₂