Name: COX-2-IN-19
Rating: 5 (10 reviews)

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HIT ID:HIT214433398
Cas No:2497530-12-6
常用名:COX-2-IN-19
IUPAC:4-{[(2-hydroxy-4-methoxyphenyl)methylidene]amino}-3-[(4-methylphenyl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione
IUPAC:4-{[(2-hydroxy-4-methoxyphenyl)methylidene]amino}-3-[(4-methylphenyl)methyl]-4,5-dihydro-1H-1,2,4-triazole-5-thione
InChI key:BEVVFCDOESEQJE-UHFFFAOYSA-N

分子式:C18H18N4O2S
分子量:354.43
氢键供体数 (HBD):
氢键受体数 (HBA):
LogP:
SMILES:COc1ccc(C=Nn2c(Cc3ccc(C)cc3)n[nH]c2=S)c(O)c1
SMILES:COc1ccc(C=Nn2c(Cc3ccc(C)cc3)n[nH]c2=S)c(O)c1

COX-2-IN-19 (Compound 24) is a highly potent inhibitor of cyclooxygenase-2 (COX-2) with an IC50 value of 1.76 μM. Notably, COX-2-IN-19 exhibits robust in vivo anti-inflammatory activity [1].

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