1-(4-Aminophenyl)sulfonyl-3-propan-2-yl-urea

HCID 285176

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Basic information

CAS: 91977-98-9
Standard SMILES: CC(C)NC(=O)NS(=O)(=O)c1ccc(N)cc1
InChIKey: LATLARRRJDLPQG-UHFFFAOYSA-N
Molecular formula: C10H15N3O3S
Average molar mass: 257.31 g/mol
Monoisotopic mass: 257.08341252

Names & identifiers

Preferred name: 1-(4-Aminophenyl)sulfonyl-3-propan-2-yl-urea
IUPAC: 1-(4-aminophenyl)sulfonyl-3-propan-2-ylurea

Names & synonyms

91977-98-9NSC141955SCHEMBL19332211DTXSID60919422NSC-141955DS-0080431-(4-aminophenyl)sulfonyl-3-propan-2-yl-ureaN-(4-Aminobenzene-1-sulfonyl)-N'-propan-2-ylcarbamimidic acidN-(4-Aminobenzene-1-sulfonyl)-N'-(propan-2-yl)carbamimidic acid

Database identifiers

CAS: 91977-98-9
PubChem CID: 285176
DTXSID: DTXSID60919422

Properties

Computed structural properties

XLogP: 0.7
Topological polar surface area: 110 Å²
Hydrogen bond donors: 3
Hydrogen bond acceptors: 4
Rotatable bonds: 3
Heavy atoms: 17
Formal charge: 0
Complexity: 353

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