5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-{[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]sulfonyl}-3,4-dihydroquinazolin-2(1H)-one

HCID 10211642
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
O=C1NCc2c(-c3ccccc3Cl)cc(S(=O)(=O)N3CCN(CCN4CCCC4)CC3)cc2N1c1c(Cl)cccc1Cl
InChIKey
XPGIDNNZZVJYFA-UHFFFAOYSA-N
Molecular formula
C30H32Cl3N5O3S
Average molar mass
649 g/mol

Names & identifiers

Preferred name
5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-{[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]sulfonyl}-3,4-dihydroquinazolin-2(1H)-one
IUPAC
5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]sulfonyl-3,4-dihydroquinazolin-2-one

Names & synonyms

SCHEMBL6673350XPGIDNNZZVJYFA-UHFFFAOYSA-N5-(2-chlorophenyl)-1-(2,6-dichlorophenyl)-7-{[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]sulfonyl}-3,4-dihydroquinazolin-2(1H)-one

Database identifiers

PubChem CID
10211642

Properties

Computed structural properties

XLogP
5.2
Topological polar surface area
84.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
7
Heavy atoms
42

Related reactions

2 records
New reaction record

Compound notes

Loading…