97Z5CC5Znz

HCID 148142

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 129224-83-5
Standard SMILES: CN(C)CCNc1nc(-c2cccs2)cc(-c2cccs2)n1
InChIKey: BGOGHNWIVJZOSC-UHFFFAOYSA-N
Molecular formula: C16H18N4S2
Average molar mass: 330.5 g/mol
Monoisotopic mass: 330.09728894

Names & identifiers

Preferred name: 97Z5CC5Znz
IUPAC: N-(4,6-dithiophen-2-ylpyrimidin-2-yl)-N',N'-dimethylethane-1,2-diamine

Names & synonyms

97Z5CC5ZNZNSC619010129224-83-5NSC 619010NSC-6190101,2-Ethanediamine, N'-(4,6-di-2-thienyl-2-pyrimidinyl)-N,N-dimethyl-UNII-97Z5CC5ZNZCHEMBL346047DTXSID301561054,6-diThien-2-yl-2-NHEtNMe2-PyrNCI60_005678N-[2-(Dimethylamino)ethyl]-4,6-di(thien-2-yl)pyrimidin-2-amine

Show more names

N-(2-(DIMETHYLAMINO)ETHYL)-4,6-BIS(THIOPHEN-2-YL)PYRIMIDIN-2-AMINEN-[4,6-bis(2-thienyl)pyrimidin-2-yl]-N',N'-dimethyl-ethane-1,2-diamine1,2-ETHANEDIAMINE, N2-(4,6-DI-2-THIENYL-2-PYRIMIDINYL)-N1,N1-DIMETHYL-N~2~-[4,6-Di(thiophen-2-yl)pyrimidin-2-yl]-N~1~,N~1~-dimethylethane-1,2-diamineN2-(4,6-DI-2-THIENYL-2-PYRIMIDINYL)-N1,N1-DIMETHYL-1,2-ETHANEDIAMINE

Database identifiers

CAS: 129224-83-5
PubChem CID: 148142
DTXSID: DTXSID30156105
ChEMBL: CHEMBL346047
UNII: 97Z5CC5ZNZ
Nikkaji: J373.922H

Properties

Computed structural properties

XLogP: 3.3
Topological polar surface area: 97.5 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 6
Rotatable bonds: 6
Heavy atoms: 22
Formal charge: 0
Complexity: 318

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…