SNS-314 mesylateProduct ingredient for SNS-314
- Name
- SNS-314 mesylate
- Drug Entry
- SNS-314
SNS-314 is a potent and selective inhibitor of Aurora kinases A, B, and C. Proliferating cells treated with SNS-314 bypass the mitotic spindle checkpoint and fail to undergo cytokinesis, leading to multiple rounds of endoreduplication and eventually cell death. SNS-314 inhibits tumor growth in a variety of preclinical models, and it is now being tested in single agent Phase 1 studies in patients with advanced solid tumours.
- Accession Number
- DBSALT002371
- Structure
- Synonyms
- Not Available
- UNII
- KGW32FDY3U
- CAS Number
- 1146618-41-8
- Weight
- Average: 527.03
Monoisotopic: 526.0318443 - Chemical Formula
- C19H19ClN6O4S3
- InChI Key
- FYCODPVDEFFWSR-UHFFFAOYSA-N
- InChI
- InChI=1S/C18H15ClN6OS2.CH4O3S/c19-11-2-1-3-12(8-11)24-17(26)25-18-21-9-13(28-18)4-6-20-16-15-14(5-7-27-15)22-10-23-16;1-5(2,3)4/h1-3,5,7-10H,4,6H2,(H,20,22,23)(H2,21,24,25,26);1H3,(H,2,3,4)
- IUPAC Name
- 1-(3-chlorophenyl)-3-{5-[2-({thieno[3,2-d]pyrimidin-4-yl}amino)ethyl]-1,3-thiazol-2-yl}urea; methanesulfonic acid
- SMILES
- CS(O)(=O)=O.ClC1=CC=CC(NC(=O)NC2=NC=C(CCNC3=C4SC=CC4=NC=N3)S2)=C1
- External Links
- ChemSpider
- 23335848
- ChEMBL
- CHEMBL518051
- Predicted Properties
Property Value Source Water Solubility 0.00971 mg/mL ALOGPS logP 3.75 ALOGPS logP 4.62 Chemaxon logS -4.6 ALOGPS pKa (Strongest Acidic) 10.16 Chemaxon pKa (Strongest Basic) 3.86 Chemaxon Physiological Charge 0 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 3 Chemaxon Polar Surface Area 91.83 Å2 Chemaxon Rotatable Bond Count 6 Chemaxon Refractivity 114.94 m3·mol-1 Chemaxon Polarizability 42.31 Å3 Chemaxon Number of Rings 4 Chemaxon Bioavailability 1 Chemaxon Rule of Five No Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule Yes Chemaxon