n,n'-Di(1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
Basic information
- CAS
5186-50-5- Standard SMILES
O=C(Nc1nccs1)c1ccc(C(=O)Nc2nccs2)cc1- InChIKey
BMLGEWZBPOSRMC-UHFFFAOYSA-N- Molecular formula
- C14H10N4O2S2
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.02451792
Names & identifiers
- Preferred name
- n,n'-Di(1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
- IUPAC
- 1-N,4-N-bis(1,3-thiazol-2-yl)benzene-1,4-dicarboxamide
Names & synonyms
NSC616165186-50-5N~1~,N~4~-Bis(1,3-thiazol-2-yl)benzene-1,4-dicarboxamiden,n'-di(1,3-thiazol-2-yl)benzene-1,4-dicarboxamideN,N'-di-1,3-thiazol-2-ylterephthalamideCambridge id 5186505NCIOpen2_007944Oprea1_701003CHEMBL2407621-N,4-N-bis(1,3-thiazol-2-yl)benzene-1,4-dicarboxamideDTXSID70966189NSC-61616
Show more names
STL257218AKOS001399568N1,N4-di(thiazol-2-yl)terephthalamideST055442AB00075029-01N~1~,N~4~-Di(1,3-thiazol-2-yl)terephthalamideN-(1,3-thiazol-2-yl)[4-(N-(1,3-thiazol-2-yl)carbamoyl)phenyl]carboxamide
Database identifiers
- CAS
5186-50-5- PubChem CID
- 247231
- DTXSID
DTXSID70966189- ChEMBL
CHEMBL240762- Nikkaji
- J2.103.475D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 378
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Compound notes
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