Methyl 4-(5-{(1R,2S)-2-[(2-furylcarbonyl)amino]-1-phenylpropoxy}-1H-indazole-1-yl)benzoate

HCID 44515372
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Basic information

Standard SMILES
COC(=O)c1ccc(-n2ncc3cc(O[C@H](c4ccccc4)[C@H](C)NC(=O)c4ccco4)ccc32)cc1
InChIKey
LDRNDMTVWJKQNA-PPHZAIPVSA-N
Molecular formula
C29H25N3O5
Average molar mass
495.5 g/mol
Monoisotopic mass
495.17942091

Names & identifiers

Preferred name
Methyl 4-(5-{(1R,2S)-2-[(2-furylcarbonyl)amino]-1-phenylpropoxy}-1H-indazole-1-yl)benzoate
IUPAC
methyl 4-[5-[(1R,2S)-2-(furan-2-carbonylamino)-1-phenylpropoxy]indazol-1-yl]benzoate

Names & synonyms

SCHEMBL833721LDRNDMTVWJKQNA-PPHZAIPVSA-NMethyl 4-(5-{(1R,2S)-2-[(2-furylcarbonyl)amino]-1-phenylpropoxy}-1H-indazole-1-yl)benzoate

Database identifiers

PubChem CID
44515372

Properties

Computed structural properties

XLogP
5.4
Topological polar surface area
95.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
9
Heavy atoms
37

Related reactions

2 records
New reaction record

Compound notes

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