5-benzyloxy-N-({1-[(5-chlorothiophen-2-yl)methyl]pyrazol-4-yl}methyl)-N-(6-isopropylpyridin-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

HCID 67184794
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Basic information

Standard SMILES
CC(C)c1ccc(N(Cc2cnn(Cc3ccc(Cl)s3)c2)C(=O)C2CCCc3c(OCc4ccccc4)cccc32)cn1
InChIKey
NRGNWXFANLWIJJ-UHFFFAOYSA-N
Molecular formula
C35H35ClN4O2S
Average molar mass
611.2 g/mol
Monoisotopic mass
610.2169252

Names & identifiers

Preferred name
5-benzyloxy-N-({1-[(5-chlorothiophen-2-yl)methyl]pyrazol-4-yl}methyl)-N-(6-isopropylpyridin-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide
IUPAC
N-[[1-[(5-chlorothiophen-2-yl)methyl]pyrazol-4-yl]methyl]-5-phenylmethoxy-N-(6-propan-2-yl-3-pyridinyl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Names & synonyms

SCHEMBL1848602NRGNWXFANLWIJJ-UHFFFAOYSA-N5-benzyloxy-N-({1-[(5-chlorothiophen-2-yl)methyl]pyrazol-4-yl}methyl)-N-(6-isopropylpyridin-3-yl)-1,2,3,4-tetrahydronaphthalene-1-carboxamide

Database identifiers

PubChem CID
67184794

Properties

Computed structural properties

XLogP
7.5
Topological polar surface area
88.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
43

Related reactions

3 records
New reaction record

Linked notes

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