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N-[(4-heptoxy-3-methoxyphenyl)-[(3-methoxybenzoyl)amino]methyl]-3-methoxybenzamide

HCID 5209331
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Basic information

CAS
7038-22-4
Standard SMILES
CCCCCCCOc1ccc(C(NC(=O)c2cccc(OC)c2)NC(=O)c2cccc(OC)c2)cc1OC
InChIKey
GWQNYJLKLWAUTL-UHFFFAOYSA-N
Molecular formula
C31H38N2O6
Average molar mass
534.6 g/mol
Monoisotopic mass
534.27298694

Names & identifiers

Preferred name
N-[(4-heptoxy-3-methoxyphenyl)-[(3-methoxybenzoyl)amino]methyl]-3-methoxybenzamide
IUPAC
N-[(4-heptoxy-3-methoxyphenyl)-[(3-methoxybenzoyl)amino]methyl]-3-methoxybenzamide

Names & synonyms

7038-22-4N-[(4-heptoxy-3-methoxyphenyl)-[(3-methoxybenzoyl)amino]methyl]-3-methoxybenzamideDTXSID70410096AKOS002720130N,N'-{[4-(Heptyloxy)-3-methoxyphenyl]methylene}bis(3-methoxybenzamide)

Database identifiers

CAS
7038-22-4
PubChem CID
5209331
DTXSID
DTXSID70410096

Properties

Computed structural properties

XLogP
6.6
Topological polar surface area
95.1 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
6
Rotatable bonds
15
Heavy atoms
39
Formal charge
0
Complexity
683

Related reactions

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Compound notes

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