| Sonrisas canónicas | C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC(=O)NN |
|---|---|
| IUPAC Name | 2-phenothiazin-10-ylacetohydrazide |
| InChIKey | DGGWSYPHEPMOBE-UHFFFAOYSA-N |
| INCHI | 1S/C14H13N3OS/c15-16-14(18)9-17-10-5-1-3-7-12(10)19-13-8-4-2-6-11(13)17/h1-8H,9,15H2,(H,16,18) |
| Isómeros SMILES | C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CC(=O)NN |
| CAS alternativo | 125096-15-3 |
| PubChem CID | 2815095 |
| Peso molecular | 271.34 |
Comprehensive hazard, handling, storage, and regulatory compliance document.
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View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Clase | Benzothiazines |
| Subclass | Phenothiazines |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Phenothiazines |
| Alternative Parents | Alkyldiarylamines Diarylthioethers Alpha amino acids and derivatives Benzenoids 1,4-thiazines Carboxylic acid hydrazides Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Phenothiazine - Alkyldiarylamine - Diarylthioether - Alpha-amino acid or derivatives - Aryl thioether - Tertiary aliphatic/aromatic amine - Para-thiazine - Benzenoid - Amino acid or derivatives - Carboxylic acid hydrazide - Tertiary amine - Carboxylic acid derivative - Azacycle - Thioether - Organooxygen compound - Organonitrogen compound - Organic oxide - Organic nitrogen compound - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as phenothiazines. These are polycyclic aromatic compounds containing a phenothiazine moiety, which is a linear tricyclic system that consists of a two benzene rings joined by a para-thiazine ring. |
| External Descriptors | Not available |
| Peso molecular | 271.340 g/mol |
|---|---|
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 4 |
| Rotatable Bond Count | 2 |
| Exact Mass | 271.078 Da |
| Monoisotopic Mass | 271.078 Da |
| Topological Polar Surface Area | 83.700 Ų |
| Heavy Atom Count | 19 |
| Formal Charge | 0 |
| Complexity | 317.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
