3-(tert-Butyloxycarbonyl)-7-(5-methyl-oxazol-2-yl)-2,3,4,5-tetrahydro-1H-3-benzazepine

HCID 23631174
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Basic information

Standard SMILES
Cc1cnc(-c2ccc3c(c2)CCN(C(=O)OC(C)(C)C)CC3)o1
InChIKey
UCKIBYXGQDGIBI-UHFFFAOYSA-N
Molecular formula
C19H24N2O3
Average molar mass
328.4 g/mol

Names & identifiers

Preferred name
3-(tert-Butyloxycarbonyl)-7-(5-methyl-oxazol-2-yl)-2,3,4,5-tetrahydro-1H-3-benzazepine
IUPAC
tert-butyl 7-(5-methyl-1,3-oxazol-2-yl)-1,2,4,5-tetrahydro-3-benzazepine-3-carboxylate

Names & synonyms

SCHEMBL4765610UCKIBYXGQDGIBI-UHFFFAOYSA-N3-(tert-Butyloxycarbonyl)-7-(5-methyl-oxazol-2-yl)-2,3,4,5-tetrahydro-1H-3-benzazepine

Database identifiers

PubChem CID
23631174

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
55.6 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
24

Related reactions

1 records
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Linked notes

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