Product Code

TRC-P712600

CAS Number

377727-87-2

Product Format

Neat

Molecular Formula

C25 H29 N9 O3

Molecular Weight

503.556

Product Categories

TRC, Chiral catalysts, ligands, & reagents

Product Type

Synthesis Tools

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

Preladenant

CAS Number

377727-87-2

Molecular Formula

C25 H29 N9 O3

Molecular Weight

503.556

Accurate Mass

503.239

SMILES

COCCOc1ccc(cc1)N2CCN(CCn3ncc4c3nc(N)n5nc(nc45)c6occc6)CC2

InChI

InChI=1S/C25H29N9O3/c1-35-15-16-36-19-6-4-18(5-7-19)32-11-8-31(9-12-32)10-13-33-23-20(17-27-33)24-28-22(21-3-2-14-37-21)30-34(24)25(26)29-23/h2-7,14,17H,8-13,15-16H2,1H3,(H2,26,29)

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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