1,3-Propanediamine → HCID 71514333, compound

HRID 540190Notes

Reaction equation

HRID 540190 reaction equation
Cl[C:2]1[C:11]2[C:6](=[CH:7][CH:8]=[C:9]([C:12]#[CH:13])[CH:10]=2)[N:5]=[C:4]([N:14]2[CH2:20][C:19]3[CH:21]=[CH:22][CH:23]=[CH:24][C:18]=3[S:17](=[O:26])(=[O:25])[CH2:16][CH2:15]2)[CH:3]=1.[CH2:27]([NH2:31])[CH2:28][CH2:29][NH2:30]>>[O:25]=[S:17]1(=[O:26])[C:18]2[CH:24]=[CH:23][CH:22]=[CH:21][C:19]=2[CH2:20][N:14]([C:4]2[CH:3]=[C:2]([NH:30][CH2:29][CH2:28][CH2:27][NH2:31])[C:11]3[C:6](=[CH:7][CH:8]=[C:9]([C:12]#[CH:13])[CH:10]=3)[N:5]=2)[CH2:15][CH2:16]1

Participants

3

Reactant 2

HCID 4281,3-PropanediamineHCID 86691400HCID 86691400, compound

Product 1

HCID 71514333HCID 71514333, compound

Procedure

The title compound was prepared in analogy to Example 52 in Scheme 22 by using 4-(4-chloro-6-ethynylquinolin-2-yl)-2,3,4,5-tetrahydro-1,4-benzothiazepine 1,1-dioxide and propane-1,3-diamine. MS obsd. (ESI+) [(M+H)+] 421, 1H NMR (400 MHz, CD3OD) δ ppm 8.25 (s, 1 H), 8.01-7.99 (d, J=7.6 Hz, 1 H), 7.94-7.92 (d, J=7.2 Hz, 1 H), 7.87-7.85 (d, J=8.8 Hz, 1 H), 7.82-7.79 (m, 1 H), 7.65-7.61 (m, 1 H), 7.50-7.47 (m, 1 H), 7.32 (s, 1 H), 5.30 (s, 2 H), 3.65-3.60 (m, 6 H), 2.70 (s, 3 H), 2.14-2.11 (t, J=5.2 Hz, 2 H).

Sources & evidence

ORD record
ord-5f7a071936054e30b3651cefb4c96347
Source dataset
uspto-grants-2014_10
Patent number
US08871756B2

Reaction notes

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