N-(2-(5-chloro-1H-indol-3-yl)ethyl)-4-phenyl-4,5-dihydrooxazole-2-carboxamide

HCID 66831767
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Basic information

Standard SMILES
O=C(NCCc1c[nH]c2ccc(Cl)cc12)C1=NC(c2ccccc2)CO1
InChIKey
ACOHQTZGFLWHKM-UHFFFAOYSA-N
Molecular formula
C20H18ClN3O2
Average molar mass
367.8 g/mol
Monoisotopic mass
367.1087545

Names & identifiers

Preferred name
N-(2-(5-chloro-1H-indol-3-yl)ethyl)-4-phenyl-4,5-dihydrooxazole-2-carboxamide
IUPAC
N-[2-(5-chloro-1H-indol-3-yl)ethyl]-4-phenyl-4,5-dihydro-1,3-oxazole-2-carboxamide

Names & synonyms

SCHEMBL892106ACOHQTZGFLWHKM-UHFFFAOYSA-NN-(2-(5-chloro-1H-indol-3-yl)ethyl)-4-phenyl-4,5-dihydrooxazole-2-carboxamide

Database identifiers

PubChem CID
66831767

Properties

Computed structural properties

XLogP
3.9
Topological polar surface area
66.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
5
Heavy atoms
26

Related reactions

3 records
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Compound notes

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