Basic information
- CAS
70650-51-0- Standard SMILES
O=C(CCCCl)NNc1nncc(-c2ccc(Cl)cc2)n1- InChIKey
UKINOWWQEQRAEZ-UHFFFAOYSA-N- Molecular formula
- C13H13Cl2N5O
- Average molar mass
- 326.18 g/mol
- Monoisotopic mass
- 325.0497154
Names & identifiers
- Preferred name
- Butyric acid, 4-chloro-, 2-(5-(4-chlorophenyl)-3-as-triazinyl)hydrazide
- IUPAC
- 4-chloro-N'-[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]butanehydrazide
Names & synonyms
BRN 0826753BUTYRIC ACID, 4-CHLORO-, 2-(5-(4-CHLOROPHENYL)-3-as-TRIAZINYL)HYDRAZIDE70650-51-03-((4-Chlorobutyryl)hydrazino)-5-(4-chlorophenyl)-1,2,4-triazine4-Chlorobutyric acid, 2-(5-(4-chlorophenyl)-3-as-triazinyl)hydrazideDTXSID20220940RefChem:331326DTXCID501434314-chloro-N'-[5-(4-chlorophenyl)-1,2,4-triazin-3-yl]butanehydrazideCHEMBL3247479
Database identifiers
- CAS
70650-51-0- PubChem CID
- 51131
- DTXSID
DTXSID20220940- ChEMBL
CHEMBL3247479- Nikkaji
- J65.873A
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 79.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 326
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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