3-Isoxazolecarboxylic acid, 5-methyl-, 2-(p-(dimethylamino)benzyl)hydrazide
Basic information
- CAS
328-33-6- Standard SMILES
Cc1cc(C(=O)NNCc2ccc(N(C)C)cc2)no1- InChIKey
SXJCEOAHKNQDJQ-UHFFFAOYSA-N- Molecular formula
- C14H18N4O2
- Average molar mass
- 274.32 g/mol
- Monoisotopic mass
- 274.14297583
Names & identifiers
- Preferred name
- 3-Isoxazolecarboxylic acid, 5-methyl-, 2-(p-(dimethylamino)benzyl)hydrazide
- IUPAC
- N'-[[4-(dimethylamino)phenyl]methyl]-5-methyl-1,2-oxazole-3-carbohydrazide
Names & synonyms
328-33-6BRN 0888583Ro 5-10253-ISOXAZOLECARBOXYLIC ACID, 5-METHYL-, 2-(p-(DIMETHYLAMINO)BENZYL)HYDRAZIDEDTXSID301864675-Methyl-3-isoxazolecarboxylic acid 2-(p-(dimethylamino)benzyl)hydrazide3-Isoxazolecarboxylic acid, 5-methyl-, 2-((4-(dimethylamino)phenyl)methyl)hydrazideRefChem:280272DTXCID401089583-Isoxazolecarboxylic acid, 5-methyl-, 2-((4-(dimethylamino)phenyl)methyl)hydrazide (9CI)N'-(4-(Dimethylamino)benzyl)-5-methylisoxazole-3-carbohydrazideN'-[[4-(DIMETHYLAMINO)PHENYL]METHYL]-5-METHYL-1,2-OXAZOLE-3-CARBOHYDRAZIDE
Show more names
N'-{[4-(DIMETHYLAMINO)PHENYL]METHYL}-5-METHYL-1,2-OXAZOLE-3-CARBOHYDRAZIDE1-(p-dimethylaminobenzyl)-2(5-methyl-3-isoxazolylcarbonyl)-hydrazine
Database identifiers
- CAS
328-33-6- PubChem CID
- 9478
- DTXSID
DTXSID30186467- Nikkaji
- J96.735A
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 70.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 316
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Compound notes
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