N-[7-(4-Bromoanilino) [1,3]thiazolo [4',5':3,4]benzo[d][1,3]thiazol-2-yl]-N'-ethylurea

HCID 86588977
Substructure searchFind similar structures

Basic information

Standard SMILES
CCNC(=O)Nc1nc2ccc3sc(Nc4ccc(Br)cc4)nc3c2s1
InChIKey
NNYNZPKCNDEYHL-UHFFFAOYSA-N
Molecular formula
C17H14BrN5OS2
Average molar mass
448.4 g/mol

Names & identifiers

Preferred name
N-[7-(4-Bromoanilino) [1,3]thiazolo [4',5':3,4]benzo[d][1,3]thiazol-2-yl]-N'-ethylurea
IUPAC
1-[7-(4-bromoanilino)-[1,3]thiazolo[5,4-e][1,3]benzothiazol-2-yl]-3-ethylurea

Names & synonyms

NNYNZPKCNDEYHL-UHFFFAOYSA-NN-[7-(4-Bromoanilino)[1,3]thiazolo[4',5': 3,4]benzo[d][1,3]thiazol-2-yl]-N'-ethylureaN-[7-(4-Bromoanilino) [1,3]thiazolo [4',5':3,4]benzo[d][1,3]thiazol-2-yl]-N'-ethylurea

Database identifiers

PubChem CID
86588977

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
135 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
4
Heavy atoms
26

Related reactions

1 records
New reaction record

Linked notes

Loading…