7-chloro-1-(2-methyl-4-nitrobenzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate -Drug Synthesis Database

【结构式】

【分子编号】67457

【品名】7-chloro-1-(2-methyl-4-nitrobenzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate

【CA登记号】　

【分子式】C₂₃H₂₅ClN₂O₅

【分子量】444.915

【元素组成】C 62.09% H 5.66% Cl 7.97% N 6.30% O 17.98%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号：(VIII)

【1】 Cordero-Vargas A, Quiclet-Sire B, Zard SZ.2006.A flexible approach for the preparation of substituted benzazepines: Application to the synthesis of tolvaptan. Bioorg Med Chem, 14: 6165～6173.
【2】 Cordero-Vargas A, Perea-Martin I, Quiclet-Sire B, et al.2004.Synthesis of substituted naphthalenes from α-tetralones generated by a xanthate radical addition-cyclisation sequence. Org Biomol Chem, 2: 3018～3025.

中间体序号	中间体编号	品名	分子式	供应商	用于合成
(I)	67450	S-(2-(4-chlorophenyl)-2-oxoethyl) O-ethyl carbonodithioate	C₁₁H₁₁ClO₂S₂	详情	详情
(II)	67451	4-(4-chlorophenyl)-1-((ethoxycarbonothioyl)thio)-4-oxobutyl pivalate	C₁₈H₂₃ClO₄S₂	详情	详情
(III)	67452	7-chloro-4-oxo-1,2,3,4-tetrahydronaphthalen-1-yl pivalate	C₁₅H₁₇ClO₃	详情	详情
(IV)	67453	(E)-7-chloro-4-(hydroxyimino)-1,2,3,4-tetrahydronaphthalen-1-yl pivalate	C₁₅H₁₈ClNO₃	详情	详情
(V)	67454	3,3,7-trichloro-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₁₅H₁₆Cl₃NO₃	详情	详情
(VI)	67455	7-chloro-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₁₅H₁₈ClNO₃	详情	详情
(VII)	67456	7-chloro-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₁₅H₂₀ClNO₂	详情	详情
(VIII)	67457	7-chloro-1-(2-methyl-4-nitrobenzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₂₃H₂₅ClN₂O₅	详情	详情
(IX)	67458	1-(4-amino-2-methylbenzoyl)-7-chloro-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₂₃H₂₇ClN₂O₃	详情	详情
(X)	67459	7-chloro-1-(2-methyl-4-(2-methylbenzamido)benzoyl)-2,3,4,5-tetrahydro-1H-benzo[b]azepin-5-yl pivalate	C₃₁H₃₃ClN₂O₄	详情	详情

Extended Information