52740-90-6
1-AMINO-N-(3-BROMO-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRYL)-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-CARBOXAMIDE
Name
1-AMINO-N-(3-BROMO-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRYL)-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-CARBOXAMIDE
Formula
C29 H15 Br N2 O5
MolWeight
551.351
1Identification
【Name】
1-AMINO-N-(3-BROMO-9,10-DIHYDRO-9,10-DIOXO-2-ANTHRYL)-9,10-DIHYDRO-9,10-DIOXOANTHRACENE-2-CARBOXAMIDE
【CAS】
【MDL】
MFCD23142763
【English Synonyms】
【Formula】
C29 H15 Br N2 O5
【MolWeight】
551.351
【Inchi】
InChI=1S/C29H15BrN2O5/c30-21-11-19-20(27(35)14-6-2-1-5-13(14)26(19)34)12-22(21)32-29(37)18-10-9-17-23(24(18)31)28(36)16-8-4-3-7-15(16)25(17)33/h1-12H,31H2,(H,32,37)
【InChIKey】
InChIKey=CNBMPLAEVDUBAN-UHFFFAOYSA-N
【SMILES】
c1ccc2c(c1)C(=O)c3ccc(c(c3C2=O)N)C(=O)Nc4cc5c(cc4Br)C(=O)c6ccccc6C5=O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:6.0
Bulk/Fine:F