Basic information
- CAS
81225-58-3- Standard SMILES
CC(C)NC(=O)N1c2ccccc2Sc2ccccc21- InChIKey
DIHZRSIYRBANNR-UHFFFAOYSA-N- Molecular formula
- C16H16N2OS
- Average molar mass
- 284.4 g/mol
- Monoisotopic mass
- 284.09833431
Names & identifiers
- Preferred name
- N-isopropyl-10H-phenothiazine-10-carboxamide
- IUPAC
- N-propan-2-ylphenothiazine-10-carboxamide
- English name
- N-(propan-2-yl)-10H-phenothiazine-10-carboxamide
- Molecular formula
- C16H16N2OS
- Molecular weight
- 284.38
Names & synonyms
81225-58-3N-isopropyl-10H-phenothiazine-10-carboxamideN-propan-2-ylphenothiazine-10-carboxamideN-(propan-2-yl)-10H-phenothiazine-10-carboxamideCHEMBL592185ZLZ3B4B26KOprea1_607910MLS001196405SCHEMBL11315494DTXSID201321174HMS1587K22HMS2859K14
Show more names
10H-Phenothiazine-10-carboxamide, N-(1-methylethyl)-
BDBM50308429STK126366AKOS000498951CCG-113325PD187477SMR000556300EU-0046799N-(methylethyl)phenothiazin-10-ylcarboxamide
Database identifiers
- CAS
81225-58-3- PubChem CID
- 704259
- DTXSID
DTXSID201321174- ChEMBL
CHEMBL592185- UNII
- ZLZ3B4B26K
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 57.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 338
Experimental & physicochemical properties
Solubility33.4 [ug/mL] (The mean of the results at pH 7.4)
Chemistry & industry
Suppliers1 total
Alinda Chemical Ltd.+7 (495) 672-17-08 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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