SUN-C5174 (S)-isomer

Base Information

Chemical Name:SUN-C5174 (S)-isomer
CAS No.:191592-36-6
Molecular Formula:C₂₂H₂₉FN₄O₂
Molecular Weight:400.496
Hs Code.:
UNII:QK5D76D47T
Nikkaji Number:J1.299.825B

Synonyms:SUN-C5174;191592-36-6;SUN-C5174 (S)-isomer;QK5D76D47T;UNII-QK5D76D47T;(8S)-5-(3-(4-(4-Fluorophenyl)piperazin-1-yl)propyl)-8-hydroxy-1-methyl-7,8-dihydro-6H-pyrrolo(3,2-C)azepin-4-one-;Pyrrolo(3,2-C)azepin-4(1H)-one, 5-(3-(4-(4-fluorophenyl)-1-piperazinyl)propyl)-5,6,7,8-tetrahydro-8-hydroxy-1-methyl-, (S)-;[3-[4-(4-Fluorophenyl)piperazin-1-yl]propyl]-8(S)-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one;SCHEMBL6622902;KBZUFSZQLVRGPR-FQEVSTJZSA-N;SUN C-5174;AKOS040749581;(8S)-5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-7,8-dihydro-6H-pyrrolo[3,2-c]azepin-4-one

Suppliers and Price of SUN-C5174 (S)-isomer

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of SUN-C5174 (S)-isomer

Chemical Property:

XLogP3:1.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:400.22745434
Heavy Atom Count:29
Complexity:549

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CN1C=CC2=C1C(CCN(C2=O)CCCN3CCN(CC3)C4=CC=C(C=C4)F)O
Isomeric SMILES:CN1C=CC2=C1[C@H](CCN(C2=O)CCCN3CCN(CC3)C4=CC=C(C=C4)F)O

Technology Process of SUN-C5174 (S)-isomer

There total 40 articles about SUN-C5174 (S)-isomer which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 89.0%

: 191591-86-3
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepine-4,8-dione

: 191592-09-3,191592-36-6
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one

Guidance literature:: With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 17h;
DOI:10.1248/cpb.48.623

Reference yield: 29.0%

: 191591-86-3
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepine-4,8-dione

: 191592-36-6
(+)-5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one

: 191592-36-6
(-)-(S)-5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one

Guidance literature:: 5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepine-4,8-dione; With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 17h;

With L-Tartaric acid; In methanol;
DOI:10.1248/cpb.48.623

Reference yield: 29.0%

: 191591-86-3
5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepine-4,8-dione

: 191592-36-6
(+)-5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one

: 191592-36-6
(-)-(S)-5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-8-hydroxy-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepin-4-one

Guidance literature:: 5-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-1-methyl-1,4,5,6,7,8-hexahydropyrrolo[3,2-c]azepine-4,8-dione; With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 17h;

With L-Tartaric acid; In methanol;
DOI:10.1248/cpb.48.623