|
Name: BAY-41-4109 S-isomer
CAS#: 476617-51-3 (Bayer 41-4109 less active enantiomer);
Chemical Formula: C18H13ClF3N3O2
Exact Mass: 395.0648
Molecular Weight: 395.7662
Elemental Analysis: C, 54.63; H, 3.31; Cl, 8.96; F, 14.40; N, 10.62; O, 8.09 |
| Storage |
-20℃ for 3 years in powder form |
| -80℃ for 2 years in solvent |
| Technical Information |
Synonym: BAY-414109 S-isomer; BAY414109 S-isomer; BAY 414109; BAY-41-4109; BAY41-4109; BAY 41-4109
IUPAC/Chemical Name: (S)-Methyl 4-(2-chloro-4-fluorophenyl)-2-(3,5-difluoropyridin-2-yl)-6-methyl-1,4-dihydropyrimidine-5-carboxylate
InChi Key: FVNJBPMQWSIGJK-UHFFFAOYSA-N
InChi Code: InChI=1S/C18H13ClF3N3O2/c1-8-14(18(26)27-2)15(11-4-3-9(20)5-12(11)19)25-17(24-8)16-13(22)6-10(21)7-23-16/h3-7,15H,1-2H3,(H,24,25)
SMILES Code: O=C(C1=C(C)NC(C2=NC=C(F)C=C2F)=NC1C3=CC=C(F)C=C3Cl)OC |
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