Basic information
- CAS
438529-78-3- Standard SMILES
O=S(=O)(NN=C1CCCCCC1)c1ccc(Cl)cc1- InChIKey
TYVGXCPFDWHHNQ-UHFFFAOYSA-N- Molecular formula
- C13H17ClN2O2S
- Average molar mass
- 300.8 g/mol
Names & identifiers
- Preferred name
- 4-chloro-N'-cycloheptylidenebenzenesulfonohydrazide
- IUPAC
- 4-chloro-N-(cycloheptylideneamino)benzenesulfonamide
- English name
- 4-chloro-N'-cycloheptylidenebenzenesulfonohydrazide
- Molecular formula
- C13H17ClN2O2S
- Molecular weight
- 300.80428
Names & synonyms
4-chloro-N'-cycloheptylidenebenzenesulfonohydrazide4-chloro-N-(cycloheptylideneamino)benzenesulfonamideZINC00484477MLS001147414CHEMBL1425876HMS2986F18STK419781AKOS003288567SMR000672778ST45160810AK-968/15359788[(4-chlorophenyl)sulfonyl](cycloheptylideneazamethyl)amine
Show more names
4-CHLORO-N'~1~-CYCLOHEPTYLIDEN-1-BENZENESULFONOHYDRAZIDE
Database identifiers
- CAS
438529-78-3- ChEMBL
CHEMBL1425876
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 66.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 399
Experimental & physicochemical properties
Solubility0.9 [ug/mL] (The mean of the results at pH 7.4)
Chemistry & industry
Suppliers1 total
SPECS[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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