Tegaserod
Properties
- Molecular formula
- C16H23N5O
- Molar mass
- 301.39 g/mol
- Exact mass
- 301.1903 Da
- logP
- 2.81Crippen estimate
- Polar surface area
- 85.3 Ų
- H-bond donors / acceptors
- 4 / 3
- Rotatable bonds
- 7
Hazards
No GHS classification is on file for this compound. That is not evidence that it is harmless.
Identifiers
CAS number
145158-71-0SMILES
CCCCCNC(=N)NN=Cc1c[nH]c2ccc(OC)cc12InChIKey
IKBKZGMPCYNSLU-UHFFFAOYSA-NInChI
InChI=1S/C16H23N5O/c1-3-4-5-8-18-16(17)21-20-11-12-10-19-15-7-6-13(22-2)9-14(12)15/h6-7,9-11,19H,3-5,8H2,1-2H3,(H3,17,18,21)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
2 names
- Hydrazinecarboximidamide, 2-[(5-methoxy-1H-indol-3-yl)methylene]-N-pentyl-
- 2-[(5-Methoxy-1H-indol-3-yl)methylene]-N-pentylhydrazinecarboximidamide
Work with Tegaserod
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
5-Methoxyindole-3-carbaldehyde10601-19-144 % similar
Melatonin8041-44-940 % similar
5-Methoxytryptamine608-07-136 % similar
6-Methoxy-1H-indole-3-carbaldehyde70555-46-336 % similar
5-Methoxytryptophol712-09-436 % similar
Melatonin73-31-436 % similar
5-Methoxy-N,N-dimethyl-1H-indole-3-methanamine16620-52-335 % similar
5-Methoxyindoleacetic acid3471-31-635 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.