(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-(4-methoxyphenyl)-1H-indol-3-yl)propanoic acid

HCID 72190091
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Basic information

Standard SMILES
COc1ccc(-c2[nH]c3ccccc3c2C[C@H](NC(=O)OCC2c3ccccc3-c3ccccc32)C(=O)O)cc1
InChIKey
QEPXZVXCRSQITL-PMERELPUSA-N
Molecular formula
C33H28N2O5
Average molar mass
532.6 g/mol

Names & identifiers

Preferred name
(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-(4-methoxyphenyl)-1H-indol-3-yl)propanoic acid
IUPAC
(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[2-(4-methoxyphenyl)-1H-indol-3-yl]propanoic acid

Names & synonyms

SCHEMBL16100941QEPXZVXCRSQITL-PMERELPUSA-N(S)-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-(4-methoxyphenyl)-1H-indol-3-yl)propanoic acid

Database identifiers

PubChem CID
72190091

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
101 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
40

Related reactions

1 records
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Compound notes

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