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CS-W001157 4
Total: USD 88.00

1-(4-Bromo-3-chlorophenyl)dihydropyrimidine-2,4(1H,3H)-dione

  • CAS No. 1693960-93-8

  • Cat. No. CS-0628567
  • Purity≥98%
  • MDL No.None

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

1-(4-Bromo-3-chlorophenyl)dihydropyrimidine-2,4(1H,3H)-dione|CS-0628567

Structure of 1693960-93-8

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General Information

  • CAS No. 1693960-93-8
  • Cat. No. CS-0628567
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, sealed storage, away from moisture and light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₈BrClN₂O₂
  • Molecular Weight None
  • Synonym(s) None
  • SMILES O=C1NC(CCN1C2=CC=C(Br)C(Cl)=C2)=O

Description

This dihydropyrimidine-2,4(1H,3H)-dione features a 4-bromo-3-chlorophenyl substituent that imparts enhanced electron deficiency and steric bulk, enabling efficient coupling in cross-coupling reactions. The scaffold exhibits bench-stable behavior and integrates readily into complex molecular architectures under standard conditions.

Application

1-(4-Bromo-3-chlorophenyl)dihydropyrimidine-2,4(1H,3H)-dione serves as a versatile building block for medicinal chemistry and heterocyclic synthesis. Its bromo and chloro substituents enable palladium-catalyzed cross-coupling reactions, while the dihydropyrimidinone core provides a stable scaffold for derivatization. The compound exhibits bench stability, facilitates purification via recrystallization, and functions as a key intermediate in the construction of biologically relevant pyrimidine-based frameworks.

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 : P260-P264-P270-P271-P280-P301+P310-P302+P352-P304+P340-P305+P351+P338-P312-P330-P332+P313-P337+P313-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   49.41
  • LogP   2.5488
  • H_Acceptors   2
  • H_Donors   1
  • Rotatable_Bonds   1

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