Basic information
- CAS
86970-55-0- Standard SMILES
CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccccc1)CS2- InChIKey
GQRKAIRIFLZLLL-UHFFFAOYSA-N- Molecular formula
- C16H16N4O2S
- Average molar mass
- 328.4 g/mol
- Monoisotopic mass
- 328.09939694
Names & identifiers
- Preferred name
- ethyl N-(5-amino-3-phenyl-2H-pyrido[4,3-b][1,4]thiazin-7-yl)carbamate
- IUPAC
- ethyl N-(5-amino-3-phenyl-2H-pyrido[4,3-b][1,4]thiazin-7-yl)carbamate
Names & synonyms
ethyl N-(5-amino-3-phenyl-2H-pyrido[4,3-b][1,4]thiazin-7-yl)carbamate86970-55-0NSC302066CHEMBL40916SCHEMBL13327534DTXSID90316324NSC-302066Carbamic acid,3-b]-1,4-thiazin-7-yl)-, ethyl esterEthyl (5-amino-3-phenyl-2H-pyrido[4,3-b][1,4]thiazin-7-yl)carbamateCarbamic acid,[5-amino-3-phenyl-2H-pyrido[4,3-b][1,4]- thiazin-7-yl]-,ethyl ester
Database identifiers
- CAS
86970-55-0- PubChem CID
- 327352
- DTXSID
DTXSID90316324- ChEMBL
CHEMBL40916
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 115 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 453
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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