5-(N-[3-thiophenecarbonyl]amino)-3-(1-(2-phenyleth-1-yl)-1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[3,2-b]pyridine

HCID 19601643

Basic information

Standard SMILES
O=C(Nc1ccc2[nH]cc(C3=CCN(CCc4ccccc4)CC3)c2n1)c1ccsc1
InChIKey
SMLHOCXPHNVZQC-UHFFFAOYSA-N
Molecular formula
C25H24N4OS
Average molar mass
428.6 g/mol

Names & identifiers

Preferred name
5-(N-[3-thiophenecarbonyl]amino)-3-(1-(2-phenyleth-1-yl)-1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[3,2-b]pyridine
IUPAC
N-[3-[1-(2-phenylethyl)-3,6-dihydro-2H-pyridin-4-yl]-1H-pyrrolo[3,2-b]pyridin-5-yl]thiophene-3-carboxamide

Names & synonyms

SCHEMBL7009440SMLHOCXPHNVZQC-UHFFFAOYSA-N5-(N-[3 -thiophenecarbonyl]amino)-3-(1-(2-phenyleth-1yl)-1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[3,2-b]pyridine5-(N-[3-thiophenecarbonyl]amino)-3-(1-(2-phenyleth-1-yl)-1,2,3,6-tetrahydropyridin-4-yl)pyrrolo[3,2-b]pyridine

Database identifiers

PubChem CID
19601643

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
89.3 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
31

Related reactions

4 records

Compound notes

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