Vitas-M small molecule compound
9-bromo-5-[3-methoxy-4-(pentyloxy)phenyl]-2-[4-(propan-2-yloxy)phenyl]-1,10b-dihydropyrazolo[1,5-c][1,3]benzoxazine
Catalog ID
STL257287
SMILES CCCCCOc1ccc(cc1OC)C1Oc2ccc(cc2C2N1N=C(C2)c1ccc(cc1)OC(C)C)Br
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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 C31H35BrN2O4 MW 579.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H35BrN2O4/c1-5-6-7-16-36-29-14-10-22(17-30(29)35-4)31-34-27(25-18-23(32)11-15-28(25)38-31)19-26(33-34)21-8-12-24(13-9-21)37-20(2)3/h8-15,17-18,20,27,31H,5-7,16,19H2,1-4H3InChIKey
KNWBGGNBZBRTQR-UHFFFAOYSA-NSynonyms
385420-96-2385420962
9bromo2(4isopropoxyphenyl)5(3methoxy4(pentyloxy)phenyl)510bdihydro1Hbenzo(e)pyrazolo(15c)(13)oxazine
9bromo5(3methoxy4(pentyloxy)phenyl)2(4(propan2yloxy)phenyl)110bdihydropyrazolo(15c)(13)benzoxazine
9BROMO5(3METHOXY4PENTOXYPHENYL)2(4PROPAN2YLOXYPHENYL)510BDIHYDRO1HPYRAZOLO(15C)(13)BENZOXAZINE
CCCCCOC1=C(C=C(C=C1)C2N3C(CC(=N3)C4=CC=C(C=C4)OC(C)C)C5=C(O2)C=CC(=C5)Br)OC
InChI=1SC31H35BrN2O4c1567163629141022(1730(29)354)313427(251823(32)111528(25)3831)1926(3334)2181224(13921)3720(2)3h8151718202731H571619H214H3
MFCD06260245
ZINC000097957126
ZINC000102789929
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