557112-47-7
BUTANAMIDE, N-[5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]-
NameBUTANAMIDE, N-[5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]-
1Identification
【Name】
BUTANAMIDE, N-[5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]-
【CAS】
【MDL】
MFCD13191383
【English Synonyms】
【Formula】
C16 H23 B N4 O3
【MolWeight】
330.194
【Inchi】
InChI=1S/C16H23BN4O3/c1-6-7-12(22)19-14-11-8-10(9-18-13(11)20-21-14)17-23-15(2,3)16(4,5)24-17/h8-9H,6-7H2,1-5H3,(H2,18,19,20,21,22)
【InChIKey】
InChIKey=ZXYVYYGVHZWKGW-UHFFFAOYSA-N
【SMILES】
B1(OC(C(O1)(C)C)(C)C)c2cc3c([nH]nc3NC(=O)CCC)nc2
【MOL File】
BUTANAMIDE, N-[5-(4,….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
BUTANAMIDE, N-[5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-PYRAZOLO[3,4-B]PYRIDIN-3-YL]-.cml