InChI=1S/C27H23N5O4/c33-23-17-24(26-29-31-32-30-26)36-25-21(23)10-6-11-22(25)28-27(34)19-12-14-20(15-13-19)35-16-5-4-9-18-7-2-1-3-8-18/h1-3,6-8,10-15,17H,4-5,9,16H2,(H,28,34)(H,29,30,31,32)

【InChIKey】

InChIKey=NBQKINXMPLXUET-UHFFFAOYSA-N

【SMILES】

c1ccc(cc1)CCCCOc2ccc(cc2)C(=O)Nc3cccc4c3oc(cc4=O)c5[nH]nnn5

【MOL File】

PRANLUKAST.mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:2

H bond acceptor:9

XLogP3:3.0

Bulk/Fine:FB

3Material Safety Data Sheet(MSDS)

4CML File

PRANLUKAST.cml

Quick Release

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103177-37-3 PRANLUKAST

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】