AC1MFIHB

2-[2-[4,5-dimethoxy-2-(4-methylpiperazin-1-yl)sulfonylphenyl]ethyl]benzo[de]isoquinoline-1,3-dione

Also Known As: VU0097274-2|2-(4,5-dimethoxy-2-((4-methylpiperazin-1-yl)sulfonyl)phenethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione|F1081-0076|3-(2-{4,5-dimethoxy-2-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}ethyl)-3-azatricyclo[7.3.1.0^{5,13}]trideca-1(12),5,7,9(13),10-pentaene-2,4-dione|2-[2-[4,5-dimethoxy-2-(4-methylpiperazin-1-yl)sulfonylphenyl]ethyl]benzo[de]isoquinoline-1,3-dione|2-(2-{4,5-dimethoxy-2-[(4-methylpiperazin-1-yl)sulfonyl]phenyl}ethyl)-1H-benzo[de]isoquinoline-1,3(2H)-dione

Molecular Formula	C27H29N3O6S
Molecular Weight	523.17773 g/mol
LogP	2.6318
Topological Polar Surface Area	96.46 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	7
Rotatable Bonds	7
Exact Mass	523.17773
Monoisotopic Mass	523.17773
Heavy Atoms	37
Complexity	1444.7574

Chemical Identifiers

CAS Number	452089-70-2
SMILES	CN1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2CCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O)OC)OC