bromocriptine

(6aR,9R)-5-bromo-N-[(1S,2S,4R,7S)-2-hydroxy-7-(2-methylpropyl)-5,8-dioxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide

CAS: 25614-03-3

Molecular Formula	`C32H40BrN5O5`
Molecular Weight	654.6 g/mol
LogP	3.8
Topological Polar Surface Area	118.0 A2
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	6
Rotatable Bonds	5
Exact Mass	653.22125
Heavy Atoms	43
Complexity	1230.0

Chemical Identifiers

CAS Number	25614-03-3
SMILES	`CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O`
InChIKey	`OZVBMTJYIDMWIL-AYFBDAFISA-N`

📖 Product Overview

bromocriptine (CAS: 25614-03-3) is a chemical compound with molecular formula C32H40BrN5O5 and molecular weight 654.6 g/mol. Its IUPAC systematic name is (6aR,9R)-5-bromo-N-[(1S,2S,4R,7S)-2-hydroxy-7-(2-methylpropyl)-5,8-dioxo-4-propan-2-yl-3-oxa-6,9-diazatricyclo[7.3.0.02,6]dodecan-4-yl]-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide. LogP 3.8 Topological Polar Surface Area 118.0 A2 Hydrogen Bond Donors 3 Hydrogen Bond Acceptors 6 Rotatable Bonds 5 Exact Mass 653.22125 Heavy Atoms 43 Complexity 1230.0 InChI Key: OZVBMTJYIDMWIL-AYFBDAFISA-N. SMILES: CC(C)CC1C(=O)N2CCCC2C3(N1C(=O)C(O3)(C(C)C)NC(=O)C4CN(C5CC6=C(NC7=CC=CC(=C67)C5=C4)Br)C)O.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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