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(4Z)-12-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(pyridin-4-yl)methylidene]-3,10-dioxa-12-azatricyclo[7.4.0.0^{2,6}]trideca-1,6,8-trien-5-one | CAS No. 951937-69-2

(4Z)-12-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(pyridin-4-yl)methylidene]-3,10-dioxa-12-azatricyclo[7.4.0.0^{2,6}]trideca-1,6,8-trien-5-one

Basic Information

$(4Z)-12-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-[(pyridin-4-yl)methylidene]-3,10-dioxa-12-azatricyclo[7.4.0.0^{2,6}]trideca-1,6,8-trien-5-one$

CAS Number

951937-69-2

Molecular Formula

C24H18N2O5

Molecular Weight

414.42 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

O=C1/C(=C/c2ccncc2)/Oc2c1ccc1c2CN(CO1)c1ccc2c(c1)OCCO2

InChI

InChI=1S/C24H18N2O5/c27-23-17-2-4-19-18(24(17)31-22(23)11-15-5-7-25-8-6-15)13-26(14-30-19)16-1-3-20-21(12-16)29-10-9-28-20/h1-8,11-12H,9-10,13-14H2/b22-11-

InChIKey

VPJIIPLWMGLYCA-JJFYIABZSA-N

LogP

3.8255000000000026

Topological Polar Surface Area

70.12 Å²

Hydrogen Bond Donor/Acceptor

0 / 7

Synonyms & References

English

(2Z)-8-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(pyridin-4-ylmethylidene)-8,9-dihydro-7H-furo[2,3-f][1,3]benzoxazin-3(2H)-one
7H-Furo[2,3-f][1,3]benzoxazin-3(2H)-one, 8-(2,3-dihydro-1,4-benzodioxin-6-yl)-8,9-dihydro-2-(4-pyridinylmethylene)-

MDL Number

MFCD09855021

Related Compounds

(R)-tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate structure

(R)-tert-Butyl 3-(4-amino-3-(4-phenoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-1-yl)piperidine-1-carboxylate

CAS Number: 1022150-11-3

Molecular Formula: C27H30N6O3

2-Hydroxy-5-nitro-1H-isoindole-1,3(2H)-dione structure

2-Hydroxy-5-nitro-1H-isoindole-1,3(2H)-dione

CAS Number: 105969-98-0

Molecular Formula: C8H4N2O5

H-Glu(otbu)-nh2 hydrochloride structure

H-Glu(otbu)-nh2 hydrochloride

CAS Number: 108607-02-9

Molecular Formula: C9H19ClN2O3

[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanone (non-preferred name) structure

[(3aS,5R,6S,6aS)-6-Hydroxy-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-5-yl](4-morpholinyl)methanone (non-preferred name)

CAS Number: 1103738-19-7

Molecular Formula: C12H19NO6

MYO-INOSITOL HEXAKIS(DIHYDROGEN PHOSPHATE), DODECASODIUM SALT HYDRATE structure

MYO-INOSITOL HEXAKIS(DIHYDROGEN PHOSPHATE), DODECASODIUM SALT HYDRATE

CAS Number: 123408-98-0

Molecular Formula: C6H8Na12O25P6

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate structure

2-Methyl-2-propanyl (3S)-3-cyano-1-pyrrolidinecarboxylate

CAS Number: 132945-78-9

Molecular Formula: C10H16N2O2

(4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone structure

(4-Chlorophenyl)(3,4-dihydroxyphenyl)methanone

CAS Number: 134612-84-3

Molecular Formula: C13H9ClO3

3-(4-Methyl-1-piperazinyl)aniline structure

3-(4-Methyl-1-piperazinyl)aniline

CAS Number: 148546-99-0

Molecular Formula: C11H17N3

(5R)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2(5H)-furanone structure

(5R)-5-[(4S)-2,2-Dimethyl-1,3-dioxolan-4-yl]-3,4-dihydroxy-2(5H)-furanone

CAS Number: 15042-01-0

Molecular Formula: C9H12O6

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