Ethyl 2-[3-[4-(2-Chlorophenyl)Piperazin-1-Yl]Propylsulfanyl]-3,7-Dimethyl-4-Oxopyrido[2,3-d]Pyrimidine-5-Carboxylate
[CAS# 147296-97-7]

Identification

• Name: Ethyl 2-[3-[4-(2-Chlorophenyl)Piperazin-1-Yl]Propylsulfanyl]-3,7-Dimethyl-4-Oxopyrido[2,3-d]Pyrimidine-5-Carboxylate
• Synonyms: Ethyl 2-[3-[4-(2-Chlorophenyl)Piperazin-1-Yl]Propylsulfanyl]-3,7-Dimethyl-4-Oxo-Pyrido[2,3-D]Pyrimidine-5-Carboxylate; 2-[3-[4-(2-Chlorophenyl)-1-Piperazinyl]Propylthio]-3,7-Dimethyl-4-Oxo-5-Pyrido[2,3-D]Pyrimidinecarboxylic Acid Ethyl Ester; 2-[3-[4-(2-Chlorophenyl)Piperazin-1-Yl]Propylthio]-4-Keto-3,7-Dimethyl-Pyrido[2,3-D]Pyrimidine-5-Carboxylic Acid Ethyl Ester
• Molecular Formula: C₂₅H₃₀ClN₅O₃S
• Molecular Weight: 516.06
• CAS Registry Number: 147296-97-7
• SMILES: C4=C(C3=C(N=C(SCCCN2CCN(C1=C(Cl)C=CC=C1)CC2)N(C3=O)C)N=C4C)C(OCC)=O
• InChI: 1S/C25H30ClN5O3S/c1-4-34-24(33)18-16-17(2)27-22-21(18)23(32)29(3)25(28-22)35-15-7-10-30-11-13-31(14-12-30)20-9-6-5-8-19(20)26/h5-6,8-9,16H,4,7,10-15H2,1-3H3
• InChIKey: CFCSZZVMUXTGPE-UHFFFAOYSA-N

Properties

• Density: 1.342g/cm³ (Cal.)
• Boiling point: 690.645°C at 760 mmHg (Cal.)
• Flash point: 371.489°C (Cal.)