3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID

CAS No.
872171-26-1
CCD No.
CCD03258680
Formula
C26H26N4O3
MolWeight
442.516

Basic Information

Product Name: 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID
CAS: 872171-26-1
English Synonyms: 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-BENZENEPROPANOIC ACID ; BENZENEPROPANOIC ACID, 3-[3-(1,1-DIMETHYLETHYL)-5-[(3-ISOQUINOLINYLCARBONYL)AMINO]-1H-PYRAZOL-1-YL]-
MDL Number.: MFCD16878701
H bond acceptor: 7
H bond donor: 2
Smile: CC(C)(C)C1=NN(C(=C1)NC(=O)C=1N=CC2=CC=CC=C2C1)C=1C=C(C=CC1)CCC(=O)O
InChi: InChI=1S/C26H26N4O3/c1-26(2,3)22-15-23(28-25(33)21-14-18-8-4-5-9-19(18)16-27-21)30(29-22)20-10-6-7-17(13-20)11-12-24(31)32/h4-10,13-16H,11-12H2,1-3H3,(H,28,33)(H,31,32)
InChiKey: InChIKey=LWRFKKBIYPTNPQ-UHFFFAOYSA-N

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