Vitas-M small molecule compound
(4aR,4bS,7aR,8S)-8-[(4-fluorophenyl)carbonyl]-7a,8-dihydro-4aH-pyrrolo[3',4':3,4]pyrrolo[1,2-b]pyridazine-5,7(4bH,6H)-dione
Catalog ID
STK555206
SMILES O=C1NC(=O)[C@H]2[C@@H]1[C@H](N1[C@@H]2C=CC=N1)C(=O)c1ccc(cc1)F
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C16H12FN3O3 MW 313.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12FN3O3/c17-9-5-3-8(4-6-9)14(21)13-12-11(15(22)19-16(12)23)10-2-1-7-18-20(10)13/h1-7,10-13H,(H,19,22,23)/t10-,11-,12-,13+/m1/s1InChIKey
JCEBWQSDVUEELZ-LPWJVIDDSA-NSynonyms
1212454-97-1(3aR4S9aR9bS)4(4fluorobenzoyl)3a49a9btetrahydropyrrolo(12)pyrrolo(35b)pyridazine13dione
(4aR4bS7aR8S)8((4fluorophenyl)carbonyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
(4aR4bS7aR8S)8(4fluorobenzoyl)7a8dihydro4aHpyrrolo(3434)pyrrolo(12b)pyridazine57(4bH6H)dione
1212454971
C1=CC2C3C(C(N2N=C1)C(=O)C4=CC=C(C=C4)F)C(=O)NC3=O
InChI=1SC16H12FN3O3c179538(469)14(21)131211(15(22)1916(12)23)102171820(10)13h171013H(H192223)t10111213+m1s1
MFCD18242848
O=C1NC(=O)(C@H)2(C@@H)1(C@H)(N1(C@@H)2C=CC=N1)C(=O)c1ccc(cc1)F
ZINC000005101113
ZINC5101113
Check stock
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Check stock on Vitas-MAvailable files
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