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CS-W001157 4
Total: USD 88.00

1-(2-Chloro-4-hydroxyphenyl)-3-cyclopropylurea

  • CAS No. 796848-79-8

  • Cat. No. CS-0014252
  • Purity≥98%
  • MDL No.MFCD20414638

*For research and further manufacturing use only, not for direct human use.

1-(2-Chloro-4-hydroxyphenyl)-3-cyclopropylurea|CS-0014252

Structure of 796848-79-8

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General Information

  • CAS No. 796848-79-8
  • Cat. No. CS-0014252
  • Purity ≥98%
  • MDL No. MFCD20414638
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₁ClN₂O₂
  • Molecular Weight 226.66
  • Synonym(s) Urea, N-(2-chloro-4-hydroxyphenyl)-N'-cyclopropyl-
  • SMILES O=C(NC1CC1)NC2=CC=C(O)C=C2Cl

Description

1-(2-Chloro-4-hydroxyphenyl)-3-cyclopropylurea features a hydroxylated aryl moiety paired with a cyclopropylurea scaffold, delivering enhanced solubility and metabolic stability. This structure integrates a chlorinated phenyl ring with a sterically constrained urea linkage, enabling precise molecular recognition in targeted biochemical applications.

Application

1-(2-Chloro-4-hydroxyphenyl)-3-cyclopropylurea serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and targeted API scaffolds. The phenolic hydroxyl group offers a site for derivatization via etherification or esterification, while the urea linkage provides hydrogen-bonding capability and metabolic stability. Its cyclopropyl substituent enhances lipophilicity and conformational rigidity, supporting structure-activity optimization. Bench-stable and amenable to standard purification methods, it functions effectively in multi-step synthesis workflows.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   61.36
  • LogP   2.3295
  • H_Acceptors   2
  • H_Donors   3
  • Rotatable_Bonds   2

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