Basic information
- CAS
5271-85-2- Standard SMILES
Nc1c(C(=O)c2ccc(Cl)cc2)sc2nc(-c3ccccc3)ccc12- InChIKey
CLCJTLFNQXCCMJ-UHFFFAOYSA-N- Molecular formula
- C20H13ClN2OS
- Average molar mass
- 364.8 g/mol
- Monoisotopic mass
- 364.0437119
Names & identifiers
- Preferred name
- (3-Amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-chlorophenyl)methanone
- IUPAC
- (3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-chlorophenyl)methanone
Names & synonyms
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)(4-chlorophenyl)methanone5271-85-2(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-chlorophenyl)methanoneCBMicro_016150Oprea1_441349Oprea1_752945DTXSID30360043CCG-5311STK788723AKOS001719469BIM-0016290.P001ST50239786
Show more names
SR-01000511383SR-01000511383-1
Database identifiers
- CAS
5271-85-2- PubChem CID
- 1069696
- DTXSID
DTXSID30360043
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 84.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 476
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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