Vitas-M small molecule compound

methyl 4-(9-chloro-7-methoxy-2-phenyl-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazin-5-yl)benzoate

Catalog ID
STK740266
SMILES COc1cc(Cl)cc2c1OC(c1ccc(cc1)C(=O)OC)N1C2CC(=N1)c1ccccc1

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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 C25H21ClN2O4 MW 448.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O4/c1-30-22-13-18(26)12-19-21-14-20(15-6-4-3-5-7-15)27-28(21)24(32-23(19)22)16-8-10-17(11-9-16)25(29)31-2/h3-13,21,24H,14H2,1-2H3
InChIKey
UCNVAOVGCZIFHQ-UHFFFAOYSA-N
Synonyms
638145-41-2
638145412
COC1=C2C(=CC(=C1)Cl)C3CC(=NN3C(O2)C4=CC=C(C=C4)C(=O)OC)C5=CC=CC=C5
InChI=1SC25H21ClN2O4c130221318(26)1219211420(156435715)2728(21)24(3223(19)22)1681017(11916)25(29)312h3132124H14H212H3
METHYL4(2CHLORO4METHOXY9PHENYL6H10AHBENZO(E)2PYRAZOLINO(15C)13OXAZIN6YL)BENZOATE
methyl4(9chloro7methoxy2phenyl110bdihydropyrazolo(15c)(13)benzoxazin5yl)benzoate
methyl4(9chloro7methoxy2phenyl510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazin5yl)benzoate
METHYL4(9CHLORO7METHOXY2PHENYL510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZIN5YL)BENZOATE
MFCD04005481
ZINC000008856453
ZINC000012194951

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.