N-[2-(4-hydroxyphenyl)ethyl]-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanamide

HCID 178447291
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Basic information

Standard SMILES
CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)C(C(=O)NCCc1ccc(O)cc1)C(C)C
InChIKey
QTASNCIHFQHQSN-UHFFFAOYSA-N
Molecular formula
C32H38N6O3
Average molar mass
554.7 g/mol
Monoisotopic mass
554.3005391

Names & identifiers

Preferred name
N-[2-(4-hydroxyphenyl)ethyl]-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanamide
IUPAC
N-[2-(4-hydroxyphenyl)ethyl]-3-methyl-2-[pentanoyl-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]amino]butanamide

Names & synonyms

SCHEMBL3404

Database identifiers

PubChem CID
66577551

Properties

Computed structural properties

XLogP
5.7
Topological polar surface area
124 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
6
Rotatable bonds
13
Heavy atoms
41

Related reactions

1 records
New reaction record

Compound notes

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