Products for Research Use Only

YS-370

CAT: 0013-GTR19168798-06Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168798-06Size:100 mg
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Description
YS-370 is an orally bioavailable small molecule that inhibits P-glycoprotein (P-gp) and moderately inhibits CYP3A4. It reverses multidrug resistance to agents like paclitaxel and colchicine in vitro and demonstrates enhanced antitumor efficacy in combination with paclitaxel in vivo.
CAS Number
2470908-79-1
Product Name Alternative
YS370, YS-370, YS 370, P-gp, Pgp
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Purity
97.50% (May vary between batches)
Solubility
DMSO:6 mg/mL (9.04 mM)
Smiles
COc1cc2ncnc (-c3c (-c4ccccc4) n (Cc4ccccc4Br) c4ccccc34) c2cc1OCCCN1CCOCC1
Molecular Formula
C37H35BrN4O3
Molecular Weight
663.6
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-[3-[4-[1-[(2-Bromophenyl)methyl]-2-phenylindol-3-yl]-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
CAS Number2470908-79-1
PubChem CID162679251
IUPAC Name4-[3-[4-[1-[(2-bromophenyl)methyl]-2-phenylindol-3-yl]-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
Molecular FormulaC37H35BrN4O3
Molecular Weight663.6
XLogP7.2
Topological Polar Surface Area61.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count45
Formal Charge0
Complexity903
SMILES
COC1=C(C=C2C(=C1)N=CN=C2C3=C(N(C4=CC=CC=C43)CC5=CC=CC=C5Br)C6=CC=CC=C6)OCCCN7CCOCC7
InChI
InChI=1S/C37H35BrN4O3/c1-43-33-23-31-29(22-34(33)45-19-9-16-41-17-20-44-21-18-41)36(40-25-39-31)35-28-13-6-8-15-32(28)42(24-27-12-5-7-14-30(27)38)37(35)26-10-3-2-4-11-26/h2-8,10-15,22-23,25H,9,16-21,24H2,1H3
InChIKey
WSOJDUFWINGDJI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[3-[4-[1-[(2-Bromophenyl)methyl]-2-phenylindol-3-yl]-7-methoxyquinazolin-6-yl]oxypropyl]morpholine
CAS: 2470908-79-1
CID: 162679251
Formula: C37H35BrN4O3
MW: 663.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight663.6
XLogP37.2
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass662.18925
Monoisotopic Mass662.18925
Topological Polar Surface Area61.6 Ų
Heavy Atom Count45
Formal Charge0
Complexity903
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes