Basic information
- CAS
1247227-08-2- Standard SMILES
CC(O)CN(C)C(=O)CSc1ccncc1- InChIKey
VTZAMHPJMKWKEE-UHFFFAOYSA-N- Molecular formula
- C11H16N2O2S
- Average molar mass
- 240.32 g/mol
- Monoisotopic mass
- 240.09324893
Names & identifiers
- Preferred name
- N-(2-Hydroxypropyl)-N-methyl-2-(4-pyridinylthio)acetamide
- IUPAC
- N-(2-hydroxypropyl)-N-methyl-2-pyridin-4-ylsulfanylacetamide
Names & synonyms
DTXSID501197306AKOS011617948N-(2-Hydroxypropyl)-N-methyl-2-(4-pyridinylthio)acetamideN-(2-Hydroxypropyl)-N-methyl-2-[(pyridin-4-yl)sulfanyl]acetamide1247227-08-2
Database identifiers
- CAS
1247227-08-2- PubChem CID
- 62333506
- DTXSID
DTXSID501197306
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 78.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 220
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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