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942183-80-4
SCH772984
Name
SCH772984
Formula
C33 H33 N9 O2
MolWeight
587.685
1Identification
【Name】
SCH772984
【CAS】
【MDL】
MFCD11878503
【English Synonyms】
【Formula】
C33 H33 N9 O2
【MolWeight】
587.685
【Inchi】
InChI=1S/C33H33N9O2/c43-30(42-18-16-41(17-19-42)27-5-2-24(3-6-27)32-35-11-1-12-36-32)22-40-15-10-25(21-40)33(44)37-26-4-7-29-28(20-26)31(39-38-29)23-8-13-34-14-9-23/h1-9,11-14,20,25H,10,15-19,21-22H2,(H,37,44)(H,38,39)/t25-/m1/s1
【InChIKey】
InChIKey=HDAJDNHIBCDLQF-RUZDIDTESA-N
【SMILES】
c1cnc(nc1)c2ccc(cc2)N3CCN(CC3)C(=O)CN4CC[C@H](C4)C(=O)Nc5ccc6c(c5)c(n[nH]6)c7ccncc7
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:11
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
SCH772984.cml
Quick Release
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