7,8-Dimethoxy-N-phenyl-4,5-dihydronaphtho[1,2-d][1,3]thiazol-2-amine
Basic information
- CAS
57595-87-6- Standard SMILES
COc1cc2c(cc1OC)-c1nc(Nc3ccccc3)sc1CC2- InChIKey
NWADDUHDGJJIIM-UHFFFAOYSA-N- Molecular formula
- C19H18N2O2S
- Average molar mass
- 338.4 g/mol
- Monoisotopic mass
- 338.10889899
Names & identifiers
- Preferred name
- 7,8-Dimethoxy-N-phenyl-4,5-dihydronaphtho[1,2-d][1,3]thiazol-2-amine
- IUPAC
- 7,8-dimethoxy-N-phenyl-4,5-dihydrobenzo[e][1,3]benzothiazol-2-amine
Names & synonyms
57595-87-6NSC251206CHEMBL3273903DTXSID203122137,8-Dimethoxy-N-phenyl-4,5-dihydronaphtho[1,2-d][1,3]thiazol-2-amineNSC-2512064,8-DIMETHOXY-N-PHENYLNAPHTHO[1,2-D]THIAZOL-2-AMINE
Database identifiers
- CAS
57595-87-6- PubChem CID
- 317784
- DTXSID
DTXSID20312213- ChEMBL
CHEMBL3273903
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 71.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 418
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Compound notes
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