Rodatristat
Product Code
TRC-R323220-75MG
CAS Number
Product Format
Neat
Molecular Formula
C29 H31 Cl F3 N5 O3
Molecular Weight
590.036
Product Categories
Price and availability
Product Information
Product Data
Analyte Name
Rodatristat
CAS Number
1673571-51-1
Molecular Formula
C29 H31 Cl F3 N5 O3
Molecular Weight
590.036
Accurate Mass
589.207
SMILES
CCOC(=O)[C@@H]1CC2(CCN(CC2)c3cc(O[C@H](c4ccc(Cl)cc4c5ccccc5)C(F)(F)F)nc(N)n3)CN1
InChI
InChI=1S/C29H31ClF3N5O3/c1-2-40-26(39)22-16-28(17-35-22)10-12-38(13-11-28)23-15-24(37-27(34)36-23)41-25(29(31,32)33)20-9-8-19(30)14-21(20)18-6-4-3-5-7-18/h3-9,14-15,22,25,35H,2,10-13,16-17H2,1H3,(H2,34,36,37)/t22-,25+/m0/s1
IUPAC
ethyl (3S)-8-[2-amino-6-[(1R)-1-(4-chloro-2-phenylphenyl)-2,2,2-trifluoroethoxy]pyrimidin-4-yl]-2,8-diazaspiro[4.5]decane-3-carboxylate
Storage & Transport Information
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Attributes
Product Format
Neat
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