Basic information
- CAS
853059-17-3- Standard SMILES
Cc1cc(C2=C(c3cc(C)sc3C)C(c3cccs3)N=C(c3ccccc3)S2)c(C)s1- InChIKey
IXMJWMVCVOYZEL-UHFFFAOYSA-N- Molecular formula
- C26H23NS4
- Average molar mass
- 477.7 g/mol
- Monoisotopic mass
- 477.07133443
Names & identifiers
- Preferred name
- 4H-1,3-Thiazine, 5,6-bis(2,5-dimethyl-3-thienyl)-2-phenyl-4-(2-thienyl)-
- IUPAC
- 5,6-bis(2,5-dimethylthiophen-3-yl)-2-phenyl-4-thiophen-2-yl-4H-1,3-thiazine
Names & synonyms
853059-17-3DTXSID004798184H-1,3-Thiazine, 5,6-bis(2,5-dimethyl-3-thienyl)-2-phenyl-4-(2-thienyl)-RefChem:297085DTXCID204306285,6-bis(2,5-dimethyl-3-thienyl)-2-phenyl-4-(2-thienyl)-4h-1,3-thiazine5,6-Bis(2,5-dimethylthiophen-3-yl)-2-phenyl-4-(thiophen-2-yl)-4H-1,3-thiazine
Database identifiers
- CAS
853059-17-3- PubChem CID
- 12190816
- DTXSID
DTXSID00479818
Properties
Computed structural properties
- XLogP
- 7.6
- Topological polar surface area
- 122 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 712
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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