CAS: 112457-95-1 - 3aalpha,4alpha,5,6,7alpha,7aalpha-Hexahydro-2-[4- [4-(2-pyrimidinyl)-1-piperazinyl]butyl]-4,7-methano-1H-isoindole-1,3(2H)-dione dihydrogen citrate

Formula: C₂₇H₃₇N₅O₉

InChI: InChI=1/C21H29N5O2.C6H8O7/c27-19-17-15-4-5-16(14-15)18(17)20(28)26(19)9-2-1-8-24-10-12-25(13-11-24)21-22-6-3-7-23-21;7-3(8)1-6(13,5(11)12)2-4(9)10/h3,6-7,15-18H,1-2,4-5,8-14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/t15-,16+,17+,18-;

InChI key: InChIKey=DMLGUJHNIWGCKM-DPFKZJTMNA-N

SMILES: O=C(O)CC(O)(C(=O)O)CC(=O)O.O=C1N(C(=O)C2C1C3CCC2C3)CCCCN4CCN(C5=NC=CC=N5)CC4

Synonyms:

• (1R*,2S*,3R*,4S*)-N-[4-[4-(2-Pyrimidinyl)-1-piperazinyl]butyl]-2,3-norbornanedicarboximide citrate
• (3aR,4R,7R,7aS)-2-{4-[4-(pyrimidin-2-yl)piperazin-1-yl]butyl}hexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione 2-hydroxypropane-1,2,3-tricarboxylate (1:1)
• 4,7-Methano-1H-isoindole-1,3(2H)-dione, hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, (3aR,4S,7R,7aS)-rel-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
• 4,7-Methano-1H-isoindole-1,3(2H)-dione, hexahydro-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]-, (3aα,4β,7β,7aα)-, 2-hydroxy-1,2,3-propanetricarboxylate (1:1)
• Sediel
• Sm-3997
• Tandospirone citrate

SM 3997

CAS: 112457-95-1

• Formula: C₂₇H₃₇N₅O₉
• Purity: 98+%
• Color and Shape: Solid
• Molecular weight: 575.6108

Tandospirone citrate

CAS: 112457-95-1

Tandospirone citrate (SM-3997 citrate) is a potent and selective 5-HT1A receptor partial agonist (Ki : …

• Formula: C₂₇H₃₇N₅O₉
• Purity: 99.83%
• Color and Shape: Solid
• Molecular weight: 575.61

Tandospirone citrate

CAS: 112457-95-1

Tandospirone citrate is a sodium carbonate salt of tandospirone, which is a 5-HT1A receptor partial …

• Formula: C₂₇H₃₇N₅O₉
• Purity: Min. 95%
• Molecular weight: 575.61 g/mol