N-Benzylisatoic anhydride

C₁₅H₁₁NO₃CAS 35710-05-5253.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₁NO₃
Molar mass: 253.26 g/mol
Exact mass: 253.0739 Da
logP: 2.00Crippen estimate
Polar surface area: 52.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

35710-05-5

SMILES

C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)OC2=O

InChIKey

XZNZVRHSHRYPDL-UHFFFAOYSA-N

InChI

InChI=1S/C15H11NO3/c17-14-12-8-4-5-9-13(12)16(15(18)19-14)10-11-6-2-1-3-7-11/h1-9H,10H2

Weigh it out

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Work with N-Benzylisatoic anhydride

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Methylisatoic anhydride10328-92-454 % similar Diphenic anhydride6050-13-141 % similar 2-Amino-1-benzylbenzimidazole43182-10-140 % similar 1-(Phenylmethyl)-1H-indole-3-carboxylic acid27018-76-438 % similar 1-Benzyl-1H-indole-3-carbaldehyde10511-51-038 % similar 3-Methylbenzo[d]oxazol-2(3H)-one21892-80-837 % similar 1-Benzyl-1H-indazol-3-ol2215-63-636 % similar N-(1-Benzyl-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carbonyl)glycine931398-72-036 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Nitrochalcone1222-98-6 N-(Carboxymethyl)acridone38609-97-1 2-Nitrochalcone7473-93-0

Elsewhere

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