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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1880948Generated: October 26, 2026

Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1) → HCID 25253070, compound

https://huagongshe.com/reaction/1880948

Reaction equation

Participants

RoleNameHCIDCharge
ReactantMethanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1)HCID 9886157—
Reactant1-Methylazetidin-3-amine dihydrochlorideHCID 44784901—
ReactantHCID 67117825HCID 67117825—
ProductHCID 25253070HCID 25253070—

Reaction Steps

The title compound was synthesized from 4-(9-cyclohexyl-7-fluoro-7-vinyl-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[5,4-b][1,4]diazepin-2-ylamino)-3-methoxybenzoic acid as described in the General procedure for amide bond synthesis using HATU and 1-methylazetidin-3-amine bis-hydrochloride. 1H NMR (400 MHz, DMSO-d6) δ ppm 1.48-2.10 (m, 8 H) 2.32 (br. s., 3 H) 3.08 (t, J=6.82 Hz, 2 H) 3.29 (br. s., 3 H) 3.62 (t, J=6.95 Hz, 2 H) 3.82 (m, 2 H) 3.94 (br. s., 3 H) 4.44 (m, 1 H) 4.88 (m, 1 H) 5.38 (d, J=12.13 Hz, 2 H) 5.99 (m, 1 H) 7.50 (br. s., 2 H) 7.84 (br. s., 1 H) 8.13 (br. s., 1 H)) 8.31 (d, J=8.0 Hz, 1 H) 8.65 (d, J=7.83 Hz, 1 H). [M+H] calculated for C27H34FN7O3, 524; found 524.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08318727B2
Source datasetuspto-grants-2012_11
ORD IDord-608d8cfb9ea24a8e82190354c8f7eee7
Source noteuspto-grants-2012_11