Structure

Raltegravir

CAS
518048-05-0
Catalog Number
ACM518048050
Category
Inhibitors
Molecular Weight
444.42
Molecular Formula
C20H21FN6O5

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Specification

Description
Raltegravir is a potent integrase (IN) inhibitor, used to treat HIV infection.
Synonyms
Raltegravir;N-((4-Fluorophenyl)methyl)-1,6-dihydro-5-hydroxy-1-methyl-2-(1-methyl-1-(((5-methyl-1,3,4-oxadiazol-2-yl)carbonyl)amino)ethyl)-6-oxo-4-pyrimidinecarboxamide;N-(2-(4-(4-Fluorobenzylcarbamoyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)propan-2-yl)-5-methyl-1,3,4-oxadiazole-2-carboxamide;N-(2-(4-(4-Fluorobenzylcarbamoyl)-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidin-2-yl)p;Raltegravir(R&D);Raltegravir(free base);N-(4-fluorobenzyl)-5-hydroxy-1-methyl-2-(2-(2-methyl-1,3,4-oxadiazole-5-carboxamido)propan-2-yl)-6-oxo-1,6-dihydropyrimidine-4-carboxamide;N-((4-Fluorophenyl)methyl)-1,6-dihydro-5-hydroxy-1-methyl-2-(1-methyl-1-(((5-methyl-1,3,4-oxadiazol-2-yl)carbonyl)am
Canonical SMILES
O=C(C(O)=C(C(NCC1=CC=C(C=C1)F)=O)N=C2C(C)(C)NC(C3=NN=C(C)O3)=O)N2C
Appearance
Solid
Storage
4°C, protect from light*In solvent : -80°C, 6 months; -20°C, 1 month (protect from light).
Shipping
Can be shipped at room temperature, where not in use may vary.
What is the molecular weight of raltegravir?

The molecular weight of raltegravir is 444.4 g/mol.

What is the IUPAC name of raltegravir?

The IUPAC name of raltegravir is N-[2-[4-[(4-fluorophenyl)methylcarbamoyl]-5-hydroxy-1-methyl-6-oxopyrimidin-2-yl]propan-2-yl]-5-methyl-1,3,4-oxadiazole-2-carboxamide.

What is the InChI key of raltegravir?

The InChI key of raltegravir is CZFFBEXEKNGXKS-UHFFFAOYSA-N.

What is the canonical SMILES of raltegravir?

The canonical SMILES of raltegravir is CC1=NN=C(O1)C(=O)NC(C)(C)C2=NC(=C(C(=O)N2C)O)C(=O)NCC3=CC=C(C=C3)F.

What is the CAS number of raltegravir?

The CAS number of raltegravir is 518048-05-0.

What is the European Community (EC) number of raltegravir?

The European Community (EC) number of raltegravir is 610-733-3.

What is the UNII of raltegravir?

The UNII of raltegravir is 22VKV8053U.

What is the ChEMBL ID of raltegravir?

The ChEMBL ID of raltegravir is CHEMBL254316.

What is the DSSTox Substance ID of raltegravir?

The DSSTox Substance ID of raltegravir is DTXSID2048660.

What is the Wikipedia page of raltegravir?

The Wikipedia page of raltegravir is "Raltegravir".

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