HuagongsheHuagongshe Chemistry Print Report · For research reference only
1-Pyrrolidinamine → HCID 25254618, compound
Participants
| Role | Name | HCID | Charge |
|---|---|---|---|
| Reactant | 1-Pyrrolidinamine | HCID 27946 | — |
| Reactant | Methanaminium, N-((dimethylamino)(3H-1,2,3-triazolo(4,5-b)pyridin-3-yloxy)methylene)-N-methyl-, hexafluorophosphate(1-) (1:1) | HCID 9886157 | — |
| Reactant | 4-(9-cyclohexyl-7,7-difluoro-5-methyl-6-oxo-6,7,8,9-tetrahydro-5H-pyrimido[4,5-b][1,4]diazepin-2-ylamino)-3-methoxy-benzoic acid | HCID 25253680 | — |
| Product | HCID 25254618 | HCID 25254618 | — |
Reaction Steps
The title compound was synthesized from 4-(9-cyclohexyl-7,7-difluoro-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 pyrrolidin-1-amine. The final compound was purified by reverse phase HPLC and basified to give the free base. 1H NMR (400 MHz, DMSO-d6) δ ppm 1.12-1.45 (m, 3H) 1.55-1.90 (m, 7H) 2.02 (br. s., 4H) 3.33 (s, 3H) 3.52 (br. s., 4H) 3.97 (s, 3H) 4.14 (t, 2H) 4.49 (quin, 1H) 7.48 (d, 1H) 7.52 (s, 1H) 8.26 (s, 1H) 8.31 (d, 1H) 8.42 (s, 1H). [M+H] calc'd for C26H33F2N7O3 530. found 530.
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|---|
| Patent number | US08026234B2 |
| Source dataset | uspto-grants-2011_09 |
| ORD ID | ord-a41bd0ff48ce40ef846af7d613847d61 |
| Source note | uspto-grants-2011_09 |