10H-Phenothiazine-10-carboxamide, 2-methoxy-N-(2-((1-methylethyl)thio)ethyl)-
Basic information
- CAS
53056-76-1- Standard SMILES
COc1ccc2c(c1)N(C(=O)NCCSC(C)C)c1ccccc1S2- InChIKey
WNMJDYZHMVZSAZ-UHFFFAOYSA-N- Molecular formula
- C19H22N2O2S2
- Average molar mass
- 374.5 g/mol
- Monoisotopic mass
- 374.1122703
Names & identifiers
- Preferred name
- 10H-Phenothiazine-10-carboxamide, 2-methoxy-N-(2-((1-methylethyl)thio)ethyl)-
- IUPAC
- 2-methoxy-N-(2-propan-2-ylsulfanylethyl)phenothiazine-10-carboxamide
Names & synonyms
BRN 116521153056-76-110H-Phenothiazine-10-carboxamide, 2-methoxy-N-(2-((1-methylethyl)thio)ethyl)-DTXSID002011162-Methoxy-N-(2-((1-methylethyl)thio)ethyl)-10H-phenothiazine-10-carboxamideRefChem:235929DTXCID001236072-Methoxy-N-{2-[(propan-2-yl)sulfanyl]ethyl}-10H-phenothiazine-10-carboxamide
Database identifiers
- CAS
53056-76-1- PubChem CID
- 3040862
- DTXSID
DTXSID00201116
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 92.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 449
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Compound notes
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