Cyanamide, [4-(4-pyridinyl)-2-pyrimidinyl]-
Basic information
- CAS
66521-67-3- Standard SMILES
N#CNc1nccc(-c2ccncc2)n1- InChIKey
OQSCZZBKDURHGZ-UHFFFAOYSA-N- Molecular formula
- C10H7N5
- Average molar mass
- 197.2 g/mol
- Monoisotopic mass
- 197.07014524
Names & identifiers
- Preferred name
- Cyanamide, [4-(4-pyridinyl)-2-pyrimidinyl]-
- IUPAC
- (4-pyridin-4-ylpyrimidin-2-yl)cyanamide
Names & synonyms
66521-67-3Cyanamide, [4-(4-pyridinyl)-2-pyrimidinyl]-[4-(pyridin-4-yl)pyrimidin-2-yl]cyanamide(4-pyridin-4-ylpyrimidin-2-yl)cyanamideCHEMBL3251545SCHEMBL10919492DTXSID201261198STK655261AKOS005585923[4-(4-pyridinyl)-2-pyrimidinyl]cyanamideN-(4-(pyridin-4-yl)pyrimidin-2-yl)cyanamide
Database identifiers
- CAS
66521-67-3- PubChem CID
- 12450583
- DTXSID
DTXSID201261198- ChEMBL
CHEMBL3251545
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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