Basic information
- Standard SMILES
CCN(CC)CCN(C(=O)NCCS(=O)(=O)c1ccccc1)C(C)C- InChIKey
LOFFHJXULNSDMZ-UHFFFAOYSA-N- Molecular formula
- C18H31N3O3S
- Average molar mass
- 369.5 g/mol
Names & identifiers
- Preferred name
- N-[2-(Diethylamino)ethyl]-N-(1-methylethyl)-N'-[2-(phenylsulfonyl)ethyl]urea
- IUPAC
- 3-[2-(benzenesulfonyl)ethyl]-1-[2-(diethylamino)ethyl]-1-propan-2-ylurea
Names & synonyms
SCHEMBL10682299LOFFHJXULNSDMZ-UHFFFAOYSA-NN-[2-(Diethylamino)ethyl]-N-(1-methylethyl)-N'-[2-(phenylsulfonyl)ethyl]urea
Database identifiers
- PubChem CID
- 20152862
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 78.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 10
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 478
Related reactions
3 records
Compound notes
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