6-Methyl-5H-benzo(a)phenothiazin-5-one
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Basic information
- CAS
26197-31-9- Standard SMILES
Cc1c2sc3ccccc3nc-2c2ccccc2c1=O- InChIKey
RTPGWOYHPVTPOX-UHFFFAOYSA-N- Molecular formula
- C17H11NOS
- Average molar mass
- 277.3 g/mol
- Monoisotopic mass
- 277.05613497
Overview
structure in first source
Names & identifiers
- Preferred name
- 6-Methyl-5H-benzo(a)phenothiazin-5-one
- IUPAC
- 6-methylbenzo[a]phenothiazin-5-one
- English name
- 6-METHYLBENZO(A)PHENOTHIAZIN-5-ONE
- Molecular formula
- C17H11NOS
- Molecular weight
- 277.34
Names & synonyms
6-Methyl-5H-benzo(a)phenothiazin-5-one26197-31-9DP1KSR9RRX6-Methyl-5H-benzo[a]phenothiazin-5-oneNSC-129958DTXSID701808286-METHYL-5-OXO-5H-BENZO(A)PHENOTHIAZINE6-methyl-5-oxo-5h-benzo[a]phenothiazineRefChem:105004DTXCID10103319UNII-DP1KSR9RRXNSC129958
Show more names
6-METHYLBENZO(A)PHENOTHIAZIN-5-ONE5H-Benzo[a]phenothiazin-5-one, 6-methyl-
NSC 1299586-methylbenzo[a]phenothiazin-5-oneSCHEMBL10500123RTPGWOYHPVTPOX-UHFFFAOYSA-N6-methyl-5H-benzo[a]phenothiazine-5-one
Database identifiers
- CAS
26197-31-9- PubChem CID
- 279441
- DTXSID
DTXSID70180828- UNII
- DP1KSR9RRX
- Nikkaji
- J444.338A
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 54.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 507
Physicochemical properties
- FDA UNII
- 1 KSR9RRX · DP1KSR9RRX
Related reactions
2 records
Compound notes
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