Basic information
- CAS
26844-09-7- Standard SMILES
O=C(NC1=CCN(CCc2c[nH]c3ccccc23)CC1)c1ccc(Cl)cc1- InChIKey
LCQNAMIZXXPNRL-UHFFFAOYSA-N- Molecular formula
- C22H22ClN3O
- Average molar mass
- 379.9 g/mol
- Monoisotopic mass
- 379.14514
Names & identifiers
- Preferred name
- Benzamide, p-chloro-N-(1,2,3,6-tetrahydro-1-(2-indol-3-ylethyl)-4-pyridyl)-
- IUPAC
- 4-chloro-N-[1-[2-(1H-indol-3-yl)ethyl]-3,6-dihydro-2H-pyridin-4-yl]benzamide
Names & synonyms
Benzamide, p-chloro-N-(1,2,3,6-tetrahydro-1-(2-indol-3-ylethyl)-4-pyridyl)-26844-09-7BRN 0500432p-Chloro-N-(1,2,3,6-tetrahydro-1-(2-indol-3-ylethyl)-4-pyridyl)benzamide4-chloro-n-{1-[2-(1h-indol-3-yl)ethyl]-1,2,3,6-tetrahydropyridin-4-yl}benzamideDTXSID30181336
Database identifiers
- CAS
26844-09-7- PubChem CID
- 213617
- DTXSID
DTXSID30181336
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 48.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 544
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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