CTK4I3272

but-2-enedioic acid;6-chloro-3-[3-[4-(3-chlorophenyl)piperazin-1-yl]propyl]-1H-quinazoline-2,4-dione

Also Known As: 6-Chloro-3-(3-(4-m-chlorophenyl-1-piperazinyl)propyl)-2,4(1H,3H)-quinazolinedione maleate|(2Z)-but-2-enedioic acid; 6-chloro-3-{3-[4-(3-chlorophenyl)piperazin-1-yl]propyl}-1,2,3,4-tetrahydroquinazoline-2,4-dione|2,4(1H,3H)-Quinazolinedione, 6-chloro-3-(3-(4-(3-chlorophenyl)-1-piperazinyl)propyl)-, (Z)-2-butenedioate (1:1)|6-Chloro-3-(3-(4-(3-chlorophenyl)piperazin-1-yl)propyl)quinazoline-2,4(1H,3H)-dione maleate|6-CHLORO-3-[3-[4-(3-CHLOROPHENYL)PIPERAZIN-1-YL]PROPYL]-1H-QUINAZOLINE-2,4-DIONE MALEATE

Molecular Formula	C25H26Cl2N4O6
Molecular Weight	548.1229 g/mol
LogP	2.9207
Topological Polar Surface Area	130.0 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	8
Rotatable Bonds	7
Exact Mass	548.1229
Monoisotopic Mass	548.1229
Heavy Atoms	37
Complexity	718.0

Chemical Identifiers

CAS Number	4052-18-0
SMILES	C1CN(CCN1CCCN2C(=O)C3=C(C=CC(=C3)Cl)NC2=O)C4=CC(=CC=C4)Cl.C(=CC(=O)O)C(=O)O
InChIKey	DFUDNETVVOCIMC-UHFFFAOYSA-N