51846-73-2
((2S,4S)-4-((5-AMINO-6-CHLOROPYRIMIDIN-4-YL)AMINO)-1-TOSYLPYRROLIDIN-2-YL)METHANOL
Name
((2S,4S)-4-((5-AMINO-6-CHLOROPYRIMIDIN-4-YL)AMINO)-1-TOSYLPYRROLIDIN-2-YL)METHANOL
Formula
C16 H20 Cl N5 O3 S
MolWeight
397.885
1Identification
【Name】
((2S,4S)-4-((5-AMINO-6-CHLOROPYRIMIDIN-4-YL)AMINO)-1-TOSYLPYRROLIDIN-2-YL)METHANOL
【CAS】
【MDL】
MFCD20228989
【English Synonyms】
【Formula】
C16 H20 Cl N5 O3 S
【MolWeight】
397.885
【Inchi】
InChI=1S/C16H20ClN5O3S/c1-10-2-4-13(5-3-10)26(24,25)22-7-11(6-12(22)8-23)21-16-14(18)15(17)19-9-20-16/h2-5,9,11-12,23H,6-8,18H2,1H3,(H,19,20,21)/t11-,12-/m0/s1
【InChIKey】
InChIKey=RXLXGVYHOBRHCP-RYUDHWBXSA-N
【SMILES】
Cc1ccc(cc1)S(=O)(=O)N2C[C@H](C[C@H]2CO)Nc3c(c(ncn3)Cl)N
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
((2S,4S)-4-((5-AMINO-6-CHLOROPYRIMIDIN-4-YL)AMINO)-1-TOSYLPYRROLIDIN-2-YL)METHANOL.cml
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Catalog No:AC12364 1G
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