6-({4-[2-(4-Tert-butylphenyl)-1,3-benzoxazol-7-yl]piperazin-1-yl}methyl)quinoxaline

HCID 11998144
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)(C)c1ccc(-c2nc3cccc(N4CCN(Cc5ccc6nccnc6c5)CC4)c3o2)cc1
InChIKey
NTQGVZQOGRZIGL-UHFFFAOYSA-N
Molecular formula
C30H31N5O
Average molar mass
477.6 g/mol
Monoisotopic mass
477.25286063

Names & identifiers

Preferred name
6-({4-[2-(4-Tert-butylphenyl)-1,3-benzoxazol-7-yl]piperazin-1-yl}methyl)quinoxaline
IUPAC
2-(4-tert-butylphenyl)-7-[4-(quinoxalin-6-ylmethyl)piperazin-1-yl]-1,3-benzoxazole

Names & synonyms

SCHEMBL4472299NTQGVZQOGRZIGL-UHFFFAOYSA-N6-({4-[2-(4-tert-butylphenyl)-1,3-benzoxazol-7-yl]piperazin-1-yl}methyl)quinoxaline

Database identifiers

PubChem CID
11998144

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
58.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
36

Related reactions

2 records
New reaction record

Linked notes

Loading…