TDI-11861 , CAS No.T614359, Inhibitor of adenylyl cyclase 10

Item Number

T614359

Grouped product items
SKU	Size	Availability	Price	Qty
T614359-5mg	5mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,334.90
T614359-25mg	25mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$1,613.90

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Synonyms

compound 33;TDI11861

Specifications & Purity

Moligand™

Grade

Moligand™

Action Type

INHIBITOR

Mechanism of action

Inhibitor of adenylyl cyclase 10

Names and Identifiers

IUPAC Name	[(3R)-4-[2-[2-[[3-(2-amino-6-chloropyrimidin-4-yl)-1-(difluoromethyl)pyrazol-4-yl]methyl]phenoxy]ethyl]morpholin-3-yl]methanol
INCHI	InChI=1S/C22H25ClF2N6O3/c23-19-10-17(27-22(26)28-19)20-15(11-31(29-20)21(24)25)9-14-3-1-2-4-18(14)34-8-6-30-5-7-33-13-16(30)12-32/h1-4,10-11,16,21,32H,5-9,12-13H2,(H2,26,27,28)/t16-/m1/s1
InChi Key	XVGSKZXXLKUEIO-MRXNPFEDSA-N
Canonical SMILES	Nc1nc(Cl)cc(c2nn(C(F)F)cc2Cc2ccccc2OCCN2CCOC[C@H]2CO)n1
Isomeric SMILES	C1COC[C@H](N1CCOC2=CC=CC=C2CC3=CN(N=C3C4=CC(=NC(=N4)N)Cl)C(F)F)CO
PubChem CID	166101565

References

1. Miller M, Rossetti T, Ferreira J, Ghanem L, Balbach M, Kaur N, Levin LR, Buck J, Kehr M, Coquille S et al.. (2022) Design, Synthesis, and Pharmacological Evaluation of Second-Generation Soluble Adenylyl Cyclase (sAC, ADCY10) Inhibitors with Slow Dissociation Rates.. J Med Chem, 65 (22): (15208-15226). [PMID:36346696] [10.1021/op500134e]
2. Balbach M, Rossetti T, Ferreira J, Ghanem L, Ritagliati C, Myers RW, Huggins DJ, Steegborn C, Miranda IC, Meinke PT et al.. (2023) On-demand male contraception via acute inhibition of soluble adenylyl cyclase.. Nat Commun, 14 (1): (637). [PMID:36788210] [10.1021/op500134e]

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Basic Description