2-(1,3-benzodioxol-5-ylcarbonyl)-N-cyclohexylhydrazinecarboxamide
Basic information
- CAS
5694-35-9- Standard SMILES
O=C(NNC(=O)c1ccc2c(c1)OCO2)NC1CCCCC1- InChIKey
UDKMXNMQBLVJFD-UHFFFAOYSA-N- Molecular formula
- C15H19N3O4
- Average molar mass
- 305.33 g/mol
- Monoisotopic mass
- 305.1375561
Names & identifiers
- Preferred name
- 2-(1,3-benzodioxol-5-ylcarbonyl)-N-cyclohexylhydrazinecarboxamide
- IUPAC
- 1-(1,3-benzodioxole-5-carbonylamino)-3-cyclohexylurea
Names & synonyms
2-(1,3-benzodioxol-5-ylcarbonyl)-N-cyclohexylhydrazinecarboxamide5694-35-9ST50914520SMR000186853CBMicro_028368MLS0005796651-(1,3-benzodioxole-5-carbonylamino)-3-cyclohexylureaCHEMBL1606893DTXSID90357797HMS2189L10STK447400AKOS001110228
Show more names
BIM-0028310.P001AB00093832-01SR-01000217332SR-01000217332-1Z331711542-(2H-1,3-Benzodioxole-5-carbonyl)-N-cyclohexylhydrazine-1-carboxamide[(2H-benzo[3,4-d]1,3-dioxolan-5-ylcarbonylamino)amino]-N-cyclohexylcarboxamide
Database identifiers
- CAS
5694-35-9- PubChem CID
- 868337
- DTXSID
DTXSID90357797- ChEMBL
CHEMBL1606893
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 88.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 412
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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