Isoxazole, 5-(p-aminobenzamido)-4-(2-butoxyethyl)-3-methyl-
Basic information
- CAS
93725-44-1- Standard SMILES
CCCCOCCc1c(C)noc1NC(=O)c1ccc(N)cc1- InChIKey
NIFYBABYILSVEV-UHFFFAOYSA-N- Molecular formula
- C17H23N3O3
- Average molar mass
- 317.4 g/mol
- Monoisotopic mass
- 317.1739416
Names & identifiers
- Preferred name
- Isoxazole, 5-(p-aminobenzamido)-4-(2-butoxyethyl)-3-methyl-
- IUPAC
- 4-amino-N-[4-(2-butoxyethyl)-3-methyl-1,2-oxazol-5-yl]benzamide
Names & synonyms
BRN 0702221ISOXAZOLE, 5-(p-AMINOBENZAMIDO)-4-(2-BUTOXYETHYL)-3-METHYL-5-(p-Aminobenzamido)-4-(2-butoxyethyl)-3-methylisoxazole93725-44-1DTXSID80239553RefChem:350249DTXCID301620444-amino-N-[4-(2-butoxyethyl)-3-methyl-1,2-oxazol-5-yl]benzamide
Database identifiers
- CAS
93725-44-1- PubChem CID
- 56695
- DTXSID
DTXSID80239553- Nikkaji
- J68.866E
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 90.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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