10H-Phenothiazine, 10-((3-nitrophenoxy)acetyl)-
Basic information
- CAS
136776-23-3- Standard SMILES
O=C(COc1cccc([N+](=O)[O-])c1)N1c2ccccc2Sc2ccccc21- InChIKey
AATLZPBHDMAZLG-UHFFFAOYSA-N- Molecular formula
- C20H14N2O4S
- Average molar mass
- 378.4 g/mol
- Monoisotopic mass
- 378.06742811
Names & identifiers
- Preferred name
- 10H-Phenothiazine, 10-((3-nitrophenoxy)acetyl)-
- IUPAC
- 2-(3-nitrophenoxy)-1-phenothiazin-10-ylethanone
Names & synonyms
BRN 488744610H-Phenothiazine, 10-((3-nitrophenoxy)acetyl)-136776-23-310-((3-Nitrophenoxy)acetyl)-10H-phenothiazineDTXSID40159920RefChem:235871DTXCID30824112-(3-NITROPHENOXY)-1-(10H-PHENOTHIAZIN-10-YL)ETHAN-1-ONE
Database identifiers
- CAS
136776-23-3- PubChem CID
- 3078035
- DTXSID
DTXSID40159920
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 533
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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