Irbesartan

CAS
138402-11-6
Catalog Number
ACM138402116
Category
Other Products
Molecular Weight
428.53
Molecular Formula
C25H28N6O

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Specification

Synonyms
3-butyl-2-[[4-[2-(2h-tetrazol-5-yl)phenyl]phenyl]methyl]-2,4-diazaspiro[4.4]non-3-en-1-one;2-BUTYL-3-[[2-(1H-TETRAZOL-5-YL)[1,1-BIPHENYL]-4-YL]METHYL]-1,3-DIAZASPIRO[4.4]NON-1-EN-4-ONE;IRBESARTAN;BMS-186295;AVAPRO;APROVEL;SR-47436;Lrbesartan
Melting Point
180-181°C
Hazard Statements
Xn
Safety Description
26
What is the molecular formula of irbesartan?

The molecular formula of irbesartan is C25H28N6O.

What is the molecular weight of irbesartan?

The molecular weight of irbesartan is 428.5 g/mol.

What is the IUPAC name of irbesartan?

The IUPAC name of irbesartan is 2-butyl-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1,3-diazaspiro[4.4]non-1-en-4-one.

What is the InChIKey for irbesartan?

The InChIKey for irbesartan is YOSHYTLCDANDAN-UHFFFAOYSA-N.

What is the canonical SMILES representation of irbesartan?

The canonical SMILES representation of irbesartan is CCCCC1=NC2(CCCC2)C(=O)N1CC3=CC=C(C=C3)C4=CC=CC=C4C5=NNN=N5.

What is the CAS number of irbesartan?

The CAS number of irbesartan is 138402-11-6.

How many hydrogen bond donor counts does irbesartan have?

Irbesartan has 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts does irbesartan have?

Irbesartan has 5 hydrogen bond acceptor counts.

How many rotatable bond counts does irbesartan have?

Irbesartan has 7 rotatable bond counts.

What is the XLogP3-AA value for irbesartan?

The XLogP3-AA value for irbesartan is 4.1.

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