Basic information
- Standard SMILES
CC1SC(=O)NN=C1c1ccc(N)cc1- InChIKey
VAKFLAOCUIOCTC-UHFFFAOYSA-N- Molecular formula
- C10H11N3OS
- Average molar mass
- 221.28 g/mol
Names & identifiers
- Preferred name
- 5-(4-aminophenyl)-6-methyl-3H,6H-1,3,4-thiadiazine-2-one
- IUPAC
- 5-(4-aminophenyl)-6-methyl-3,6-dihydro-1,3,4-thiadiazin-2-one
Names & synonyms
SCHEMBL6234593VAKFLAOCUIOCTC-UHFFFAOYSA-N5-(4-aminophenyl)-6-methyl-3H,6H -1,3,4-thiadiazine-2-one5-(4-aminophenyl)-6-methyl-3H,6H-1,3,4-thiadiazine-2-one(+) 5-(4-aminophenyl)-6-methyl-3,6-dihydro-[1,3,4]-thiadiazin-2-one
Database identifiers
- PubChem CID
- 22498613
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 284
Related reactions
4 records
Compound notes
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