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G protein-coupled receptors (GPCRs)
Angiotensin receptors
N-benzyl-N-[2-ethyl-4-oxo-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinazolin-6-yl]thiophene-2-carboxamide , CAS No.N608893, Antagonist of AT 1 receptor;Antagonist of AT 2 receptor

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N-benzyl-N-[2-ethyl-4-oxo-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinazolin-6-yl]thiophene-2-carboxamide , CAS No.N608893, Antagonist of AT 1 receptor;Antagonist of AT 2 receptor

Moligand™

PubChem CID: 15780052

Item Number

N608893

Grouped product items
SKU	Size	Availability	Price	Qty
N608893-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
N608893-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$2,000.90

View related series

AT1 receptor Antagonist AT2 receptor Antagonist

Basic Description

Synonyms	compound 13 [Glinka et al., 1994);L-161,638;L-161638;compound 1
Specifications & Purity	Moligand™
Grade	Moligand™
Action Type	ANTAGONIST
Mechanism of action	Antagonist of AT 1 receptor;Antagonist of AT 2 receptor

Associated Targets

AGTR1 Tclin Type-1 angiotensin II receptor 0 Activities

Discover Target: AGTR1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AGTR2 Tchem Type-2 angiotensin II receptor 0 Activities

Discover Target: AGTR2

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

AGT Tbio Angiotensinogen 0 Activities

Discover Target: AGT

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

Names and Identifiers

IUPAC Name	N-benzyl-N-[2-ethyl-4-oxo-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]quinazolin-6-yl]thiophene-2-carboxamide
INCHI	InChI=1S/C36H29N7O2S/c1-2-33-37-31-19-18-27(42(22-24-9-4-3-5-10-24)36(45)32-13-8-20-46-32)21-30(31)35(44)43(33)23-25-14-16-26(17-15-25)28-11-6-7-12-29(28)34-38-40-41-39-34/h3-21H,2,22-23H2,1H3,(H,38,39,40,41)
InChi Key	KDPHUUTUDFDLBT-UHFFFAOYSA-N
Canonical SMILES	CCc1nc2c(cc(cc2)N(Cc2ccccc2)C(=O)c2cccs2)c(=O)n1Cc1ccc(cc1)c1ccccc1c1n[nH]nn1
Isomeric SMILES	CCC1=NC2=C(C=C(C=C2)N(CC3=CC=CC=C3)C(=O)C4=CC=CS4)C(=O)N1CC5=CC=C(C=C5)C6=CC=CC=C6C7=NNN=N7
PubChem CID	15780052

Database links

PubChem CID	15780052
BindingDB Ligand	50282708
ChEMBL Ligand	CHEMBL289472
RCSB PDB Ligand	8ES
GPCRdb Ligand	compound 1 [PMID: 28379944]

Certificates

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References

1. Zhang H, Han GW, Batyuk A, Ishchenko A, White KL, Patel N, Sadybekov A, Zamlynny B, Rudd MT, Hollenstein K et al.. (2017) Structural basis for selectivity and diversity in angiotensin II receptors.. Nature, 544 (7650): (327-332). [PMID:28379944]

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