11-(1-Methylpiperidin-4-ylidene)-6,11-dihydro-5H-benzo[D]imidazo[1,2-A]azepine

C₁₈H₂₁N₃CAS 147083-36-1279.39 g/mol

Open in Covalent MOL file

Alkene Tertiary amine

Properties

Molecular formula: C₁₈H₂₁N₃
Molar mass: 279.39 g/mol
Exact mass: 279.1735 Da
logP: 2.97Crippen estimate
Polar surface area: 21.1 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 0

Identifiers

CAS number

147083-36-1

SMILES

CN1CCC(=C2C3=CC=CC=C3CCN4C2=NC=C4)CC1

InChIKey

GKTUOCXSVQTQJF-UHFFFAOYSA-N

InChI

InChI=1S/C18H21N3/c1-20-10-6-15(7-11-20)17-16-5-3-2-4-14(16)8-12-21-13-9-19-18(17)21/h2-5,9,13H,6-8,10-12H2,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

6,11-Dihydro-11-(1-methyl-4-piperidinylidene)-5H-imidazo[2,1-b][3]benzazepine

Work with 11-(1-Methylpiperidin-4-ylidene)-6,11-dihydro-5H-benzo[D]imidazo[1,2-A]azepine

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

Alcaftadine147084-10-459 % similar Pizotifen15574-96-649 % similar Azatadine maleate3978-86-748 % similar N-Methyldesloratadine38092-89-644 % similar Cyproheptadine129-03-343 % similar Ketotifen34580-13-741 % similar Cyproheptadine hydrochloride969-33-541 % similar Cyproheptadine hydrochloride sesquihydrate41354-29-439 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook