N-(3,5-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
Basic information
- CAS
5387-59-7- Standard SMILES
COc1ccc(-n2nnnc2SCC(=O)Nc2cc(OC)cc(OC)c2)cc1- InChIKey
OFLFHKAWFNTXSM-UHFFFAOYSA-N- Molecular formula
- C18H19N5O4S
- Average molar mass
- 401.4 g/mol
- Monoisotopic mass
- 401.11577528
Names & identifiers
- Preferred name
- N-(3,5-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
- IUPAC
- N-(3,5-dimethoxyphenyl)-2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
Names & synonyms
BAS 043738435387-59-7DTXSID20360072AKOS000669503ST50274831N-(3,5-Dimethoxyphenyl)-2-{[1-(4-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamideN-(3,5-DIMETHOXYPHENYL)-2-{[1-(4-METHOXYPHENYL)-1,2,3,4-TETRAZOL-5-YL]SULFANYL}ACETAMIDE
Database identifiers
- CAS
5387-59-7- PubChem CID
- 1073201
- DTXSID
DTXSID20360072
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 126 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 8
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 483
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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