BGC > Produktsuche > Imatinib related substance B | 571186-93-1

Molecular Formula: C29H31N7O3
Molecular Weight: 525.60154

Description:
An impurity of Imatinib, a tyrosine kinase receptor inhibitor used for cancer therapy.

• Molecular Weight:525.62
• Melting Point:209-211°C
• Purity:> 95%

Molecular Formula:
C29H31N7O3
Canonical SMILES:
CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C[N+]3(CC[N+](CC3)(C)[O-])[O-])NC4=NC=CC(=N4)C5=CN=CC=C5
InChI:
InChI=1S/C29H31N7O3/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36(39)16-14-35(2,38)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
InChIKey:
MFKGVMIUOYNDCV-UHFFFAOYSA-N
Appearance:
Off-White Solid
Synonyms:
Imatinib (Piperidine)-N,N-dioxide; 4-[(4-Methyl-1,4-dioxido-1-piperazinyl)methyl]-N-[4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzamide