4-((4-Benzylpiperidin-1-yl)sulfonyl)aniline
Completing data — refresh the page later to see the latest
Basic information
- CAS
750607-84-2- Standard SMILES
Nc1ccc(S(=O)(=O)N2CCC(Cc3ccccc3)CC2)cc1- InChIKey
GSWWKMKEEYPCBQ-UHFFFAOYSA-N- Molecular formula
- C18H22N2O2S
- Average molar mass
- 330.4 g/mol
- Monoisotopic mass
- 330.14019912
Names & identifiers
- Preferred name
- 4-((4-Benzylpiperidin-1-yl)sulfonyl)aniline
- IUPAC
- 4-(4-benzylpiperidin-1-yl)sulfonylaniline
- English name
- 4-((4-BENZYLPIPERIDIN-1-YL)SULFONYL)ANILINE
- Molecular formula
- C18H22N2O2S
- Molecular weight
- 330.44
Names & synonyms
750607-84-24-((4-benzylpiperidin-1-yl)sulfonyl)aniline4-[(4-benzylpiperidin-1-yl)sulfonyl]anilineRefChem:509334996-604-54-[[4-(Phenylmethyl)-1-piperidinyl]sulfonyl]benzenamineMFCD062551784-(4-benzylpiperidin-1-yl)sulfonylaniline4-[(4-benzyl-1-piperidyl)sulfonyl]aniline4-{[4-benzylpiperidyl]sulfonyl}phenylamine4-(4-Benzyl-piperidine-1-sulfonyl)-phenylamineMLS001174462
Show more names
Benzenamine, 4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]-
CHEMBL1492258HMS2850O03SBB039177AKOS000267319SMR000588410SY132434CS-0221674ST45255465
Database identifiers
- CAS
750607-84-2- PubChem CID
- 2115228
- ChEMBL
CHEMBL1492258- EC Number
- 996-604-5
Properties
Computed structural propertiesFilling in
- XLogP
- 3.1
- Topological polar surface area
- 71.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 452
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…