N-Cyclopentyl-4-{[(2-{[(1S)-2-(1H-imidazol-1-yl)-1-phenylethyl]oxy}-5-oxo-5,6,7,8-tetrahydro-1-naphthalenyl)methyl]sulfonyl}benzamide
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Basic information
- Standard SMILES
O=C(NC1CCCC1)c1ccc(S(=O)(=O)Cc2c(O[C@H](Cn3ccnc3)c3ccccc3)ccc3c2CCCC3=O)cc1- InChIKey
JNEYRNGADLUMKM-MGBGTMOVSA-N- Molecular formula
- C34H35N3O5S
- Average molar mass
- 597.7 g/mol
Names & identifiers
- Preferred name
- N-Cyclopentyl-4-{[(2-{[(1S)-2-(1H-imidazol-1-yl)-1-phenylethyl]oxy}-5-oxo-5,6,7,8-tetrahydro-1-naphthalenyl)methyl]sulfonyl}benzamide
- IUPAC
- N-cyclopentyl-4-[[2-[(1S)-2-imidazol-1-yl-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methylsulfonyl]benzamide
Names & synonyms
SCHEMBL6301042JNEYRNGADLUMKM-MGBGTMOVSA-NN-Cyclopentyl-4-{[(2-{[(1S)-2-(1H-imidazol-1-yl)-1-phenylethyl]oxy}-5-oxo-5,6,7,8-tetrahydro-1-naphthalenyl)methyl]sulfonyl}benzamide
Database identifiers
- PubChem CID
- 69735561
Properties
Computed structural propertiesFilling in
- XLogP
- 4.5
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 1,040
Related reactions
1 records
Compound notes
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