3-(2-Diethylaminoethyl)quinazola-4-thione
Basic information
- CAS
22204-73-5- Standard SMILES
CCN(CC)CCn1cnc2ccccc2c1=S- InChIKey
XVSKDESUFFMAIY-UHFFFAOYSA-N- Molecular formula
- C14H19N3S
- Average molar mass
- 261.39 g/mol
- Monoisotopic mass
- 261.12996879
Names & identifiers
- Preferred name
- 3-(2-Diethylaminoethyl)quinazola-4-thione
- IUPAC
- 3-[2-(diethylamino)ethyl]quinazoline-4-thione
Names & synonyms
0HN37A9JXD3-(2-Diethylaminoethyl)quinazola-4-thioneUNII-0HN37A9JXD4(3H)-Quinazolinethione, 3-(2-(diethylamino)ethyl)-22204-73-5RefChem:198176
Database identifiers
- CAS
22204-73-5- PubChem CID
- 31054
- UNII
- 0HN37A9JXD
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 50.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 312
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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