Tozasertib 陶扎色替
CAS 639089-54-6 MFCD39089546
化学结构图
SMILES: Cc1cc(Nc2cc(N3CCN(C)CC3)nc(Sc3ccc(NC(=O)C4CC4)cc3)n2)[nH]n1
化学属性
| Mol. Weight | 464.59 |
|---|---|
| Mol. Formula | C23H28N8OS |
| Appearance | white solid powder |
| Solubility | Soluble in DMSO, not in water |
别名和识别编码
| CAS Number | 639089-54-6 |
|---|---|
| Chemical Name | Tozasertib |
| Synonym | MK 0457 N-[4-[[4-(4-Methyl-1-piperazinyl)-6-[(5-methyl-1H-pyrazol-3-yl)amino]-2-pyrimidinyl]thio]phenyl]cyclopropanecarboxamide VX 680 VX680; VX 680; VX-680; MK0457; MK 0457; MK-0457; VE465; VE-465; VE 465; Tozasertib |
| Chemical Name Translation | 陶扎色替 |
| Formula | C23H28N8OS |
| IUPAC Name | (N-[4({4-(4-methylpiperazin-1-yl)-6-[(3-methyl-1H-pyrazol-5 -yl)amino]pyrimidin-2-yl}thio)phenyl]cyclopropanecarboxamide) |
| InChIKey | GCIKSSRWRFVXBI-UHFFFAOYSA-N |
| InChI | InChI=1S/C23H28N8OS/c1-15-13-20(29-28-15)25-19-14-21(31-11-9-30(2)10-12-31)27-23(26-19)33-18-7-5-17(6-8-18)24-22(32)16-3-4-16/h5-8,13-14,16H,3-4,9-12H2,1-2H3,(H,24,32)(H2,25,26,27,28,29) |
| Canonical SMILES | O=C(C1CC1)NC2=CC=C(SC3=NC(NC4=CC(C)=NN4)=CC(N5CCN(C)CC5)=N3)C=C2 |
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分类
- Aromatics
- Heterocycles
- Mutagenesis Research Chemicals
- Pharmaceuticals
- Intermediates & Fine Chemicals
产品应用
- Tozasertib, also known as VX-680, MK0457 or VE465, is a synthetic, small-molecule Aurora kinase inhibitor with potential antitumor activity. Tozasertib binds to and inhibits Aurora kinases (AKs), thereby inducing apoptosis in tumor cells in which AKs are overexpressed. AKs, a family of serine-threonine kinases, are essential for mitotic progression, spindle formation, centrosome maturation, chromosomal segregation, and cytokinesis.
相关文献及参考
- Ulisse, S., et al.: J. Endocrinol., 204, 135 (2010),
- McDermott, U., et al.: Cancer Res., 70, 1625 (2010),
- Donato, N., et al.: Biochem., Pharmacol., 79, 688 (2010),
