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Bioactive Small Molecules
Ligand families
Activin and Inhibin
4-(2-Oxo-1,2,4,5-tetrahydro-3H-1,3-benzodiazepine-3-yl)piperidine-1-carboxylic acid (R)-alpha-((4-morpholinopiperidino)carbonyl)-3,5-dimethyl-4-hydroxyphenethyl ester , Calcitonin gene-related peptide type 1 receptor antagonist, CAS No.866086-05-7, Calcitonin gene-related peptide type 1 receptor antagonist

4-(2-Oxo-1,2,4,5-tetrahydro-3H-1,3-benzodiazepine-3-yl)piperidine-1-carboxylic acid (R)-alpha-((4-morpholinopiperidino)carbonyl)-3,5-dimethyl-4-hydroxyphenethyl ester , Calcitonin gene-related peptide type 1 receptor antagonist, CAS No.866086-05-7, Calcitonin gene-related peptide type 1 receptor antagonist

Item Number

O671154

Grouped product items
SKU	Size	Availability	Price	Qty
O671154-1mg	1mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$999.90

Basic Description

Synonyms	BI-44370 \| HTLWMOKBJQKDIJ-WJOKGBTCSA-N \| J3.353.239C \| Q27268496 \| 7L3WOA232W \| BI44370 \| 4-(2-Oxo-1,2,4,5-tetrahydro-3H-1,3-benzodiazepine-3-yl)piperidine-1-carboxylic acid (R)-alpha-((4-morpholinopiperidino)carbonyl)-3,5-dimethyl-4-hydroxyphenethyl este
Action Type	ANTAGONIST
Mechanism of action	Calcitonin gene-related peptide type 1 receptor antagonist

ALogP	3.7

CALCRL Tclin Calcitonin gene-related peptide type 1 receptor (1 Activities)

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

CALCRL Tclin Calcitonin gene-related peptide type 1 receptor (1509 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Homo sapiens (32628 Activities)

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

IUPAC Name	[(2R)-3-(4-hydroxy-3,5-dimethylphenyl)-1-(4-morpholin-4-ylpiperidin-1-yl)-1-oxopropan-2-yl] 4-(2-oxo-4,5-dihydro-1H-1,3-benzodiazepin-3-yl)piperidine-1-carboxylate
INCHI	InChI=1S/C35H47N5O6/c1-24-21-26(22-25(2)32(24)41)23-31(33(42)38-12-8-28(9-13-38)37-17-19-45-20-18-37)46-35(44)39-14-10-29(11-15-39)40-16-7-27-5-3-4-6-30(27)36-34(40)43/h3-6,21-22,28-29,31,41H,7-20,23H2,1-2H3,(H,36,43)/t31-/m1/s1
InChi Key	HTLWMOKBJQKDIJ-WJOKGBTCSA-N
Canonical SMILES	CC1=CC(=CC(=C1O)C)CC(C(=O)N2CCC(CC2)N3CCOCC3)OC(=O)N4CCC(CC4)N5CCC6=CC=CC=C6NC5=O
Isomeric SMILES	CC1=CC(=CC(=C1O)C)C[C@H](C(=O)N2CCC(CC2)N3CCOCC3)OC(=O)N4CCC(CC4)N5CCC6=CC=CC=C6NC5=O
PubChem CID	23654987
Molecular Weight	633.8

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