2H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(m-chlorophenyl)-5-(2-hydroxyethyl)-
Basic information
- CAS
23515-22-2- Standard SMILES
OCCN1CSC(=S)N(c2cccc(Cl)c2)C1- InChIKey
UNBIMHCUKSBNLF-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2OS2
- Average molar mass
- 288.8 g/mol
- Monoisotopic mass
- 288.0157831
Names & identifiers
- Preferred name
- 2H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(m-chlorophenyl)-5-(2-hydroxyethyl)-
- IUPAC
- 3-(3-chlorophenyl)-5-(2-hydroxyethyl)-1,3,5-thiadiazinane-2-thione
Names & synonyms
23515-22-22H-1,3,5-Thiadiazine-2-thione, tetrahydro-3-(m-chlorophenyl)-5-(2-hydroxyethyl)-Tetrahydro-3-(m-chlorophenyl)-5-(2-hydroxyethyl)-2H-1,3,5-thiadiazine-2-thioneDTXSID10178087RefChem:267752DTXCID401005783-(3-chlorophenyl)-5-(2-hydroxyethyl)-1,3,5-thiadiazinane-2-thione
Database identifiers
- CAS
23515-22-2- PubChem CID
- 211669
- DTXSID
DTXSID10178087
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 84.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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