Basic information
- CAS
6290-69-3- Standard SMILES
COc1ccc(NC(=S)N(Cc2ccc(OC)c(OC)c2)Cc2ccco2)c(OC)c1- InChIKey
VZQPBYHOGVVFTC-UHFFFAOYSA-N- Molecular formula
- C23H26N2O5S
- Average molar mass
- 442.5 g/mol
- Monoisotopic mass
- 442.15624311
Names & identifiers
- Preferred name
- N'-(2,4-Dimethoxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]-N-[(furan-2-yl)methyl]thiourea
- IUPAC
- 3-(2,4-dimethoxyphenyl)-1-[(3,4-dimethoxyphenyl)methyl]-1-(furan-2-ylmethyl)thiourea
Names & synonyms
6290-69-3DTXSID00411172N'-(2,4-Dimethoxyphenyl)-N-[(3,4-dimethoxyphenyl)methyl]-N-[(furan-2-yl)methyl]thiourea
Database identifiers
- CAS
6290-69-3- PubChem CID
- 5222811
- DTXSID
DTXSID00411172
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 97.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 554
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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