Basic information
- CAS
74396-45-5- Standard SMILES
COc1ccc2c(n1)Sc1nc3ccccc3nc1N2- InChIKey
LQIKBHOZELDRRD-UHFFFAOYSA-N- Molecular formula
- C14H10N4OS
- Average molar mass
- 282.32 g/mol
- Monoisotopic mass
- 282.05753213
Names & identifiers
- Preferred name
- 2-Methoxy-5H-pyrido(3',2':5,6)(1,4)thiazino(2,3-b)quinoxaline
- IUPAC
- 5-methoxy-2-thia-4,9,11,18-tetrazatetracyclo[8.8.0.03,8.012,17]octadeca-1(18),3(8),4,6,10,12,14,16-octaene
Names & synonyms
74396-45-5MP2Y265TQ72-Methoxy-5H-pyrido(3',2':5,6)(1,4)thiazino(2,3-b)quinoxalineUNII-MP2Y265TQ7NSC 367416NSC-367416DTXSID502253822-Methoxy-5H-pyrido[3',2':5,6][1,4]thiazino[2,3-b]quinoxaline5H-PYRIDO(3',2':5,6)(1,4)THIAZINO(2,3-B)QUINOXALINE, 2-METHOXY-RefChem:87865DTXCID50147873NSC367416
Show more names
MLS000756920Oprea1_451033SCHEMBL2683012CHEMBL1549568HMS2852O21NCGC00246804-01SMR000528993DS-004215
Database identifiers
- CAS
74396-45-5- PubChem CID
- 339701
- DTXSID
DTXSID50225382- ChEMBL
CHEMBL1549568- UNII
- MP2Y265TQ7
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 85.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 358
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…