808756-67-4
ABT-102
Name
ABT-102
Formula
C21 H24 N4 O
MolWeight
348.448
1Identification
【Name】
ABT-102
【CAS】
808756-71-0
;808756-67-4
【MDL】
MFCD13248650
【English Synonyms】
【Formula】
C21 H24 N4 O
【MolWeight】
348.448
【Inchi】
InChI=1S/C21H24N4O/c1-21(2,3)14-8-9-15-13(11-14)7-10-18(15)24-20(26)23-17-5-4-6-19-16(17)12-22-25-19/h4-6,8-9,11-12,18H,7,10H2,1-3H3,(H,22,25)(H2,23,24,26)/t18-/m1/s1
【InChIKey】
InChIKey=TYOYXJNGINZFET-GOSISDBHSA-N
【SMILES】
CC(C)(C)c1ccc2c(c1)CC[C@H]2NC(=O)Nc3cccc4c3cn[nH]4
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:5
XLogP3:4.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ABT-102.cml
Quick Release
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