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Ketone, methyl 10-(3-morpholinopropyl)phenothiazin-2-yl

HCID 60405
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
110147-48-3
Standard SMILES
CC(=O)c1ccc2c(c1)N(CCCN1CCOCC1)c1ccccc1S2
InChIKey
LHIVZMCFFLIJNK-UHFFFAOYSA-N
Molecular formula
C21H24N2O2S
Average molar mass
368.5 g/mol
Monoisotopic mass
368.15584919

Names & identifiers

Preferred name
Ketone, methyl 10-(3-morpholinopropyl)phenothiazin-2-yl
IUPAC
1-[10-(3-morpholin-4-ylpropyl)phenothiazin-2-yl]ethanone

Names & synonyms

Methyl 10-(3-morpholinopropyl)phenothiazin-2-yl ketone3-Acetyl-10-(3'-morpholinopropyl)phenothiazin110147-48-3KETONE, METHYL 10-(3-MORPHOLINOPROPYL)PHENOTHIAZIN-2-YLRefChem:350474DTXSID909115101-{10-[3-(MORPHOLIN-4-YL)PROPYL]-10H-PHENOTHIAZIN-2-YL}ETHAN-1-ONE

Database identifiers

CAS
110147-48-3
PubChem CID
60405
DTXSID
DTXSID90911510
Nikkaji
J71.234E

Properties

Computed structural properties

XLogP
3.1
Topological polar surface area
58.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Formal charge
0
Complexity
483

Related reactions

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Compound notes

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