InChI=1S/C26H29Cl2N5O3/c1-32-6-8-33(9-7-32)5-4-10-36-25-13-21-18(11-24(25)35-3)26(17(15-29)16-30-21)31-22-14-23(34-2)20(28)12-19(22)27/h11-14,16H,4-10H2,1-3H3,(H,30,31)

【InChIKey】

InChIKey=UBPYILGKFZZVDX-UHFFFAOYSA-N

【SMILES】

CN1CCN(CC1)CCCOc2cc3c(cc2OC)c(c(cn3)C#N)Nc4cc(c(cc4Cl)Cl)OC

【MOL File】

BOSUTINIB.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:1

H bond acceptor:8

XLogP3:4.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

【Safety informationSymbol】

GHS07

【hazard symbol】

【Risk Code】

【Safe Code】

【WGK Germany】

4CML File

BOSUTINIB.cml

Quick Release

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1391063-17-4 BOSUTINIB

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】