Basic information
- Standard SMILES
Cc1cc(C[C@@H](OC(=O)N2CCC(c3cc4ccccc4[nH]c3=O)CC2)C(=O)N2CCC(N3CC=CCC3)CC2)cc2cn[nH]c12- InChIKey
OFQWTOOSUIGQBP-JGCGQSQUSA-N- Molecular formula
- C36H42N6O4
- Average molar mass
- 622.8 g/mol
Names & identifiers
- Preferred name
- (R)-1-(4-(5,6-dihydropyridin-1(2H)-yl)piperidin-1-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-2-yl 4-(2-oxo-1,2-dihydroquinolin-3-yl)piperidine-1-carboxylate
- IUPAC
- [(2R)-1-[4-(3,6-dihydro-2H-pyridin-1-yl)piperidin-1-yl]-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-2-yl] 4-(2-oxo-1H-quinolin-3-yl)piperidine-1-carboxylate
Names & synonyms
CHEMBL499488(R)-1-(4-(5,6-dihydropyridin-1(2H)-yl)piperidin-1-yl)-3-(7-methyl-1H-indazol-5-yl)-1-oxopropan-2-yl 4-(2-oxo-1,2-dihydroquinolin-3-yl)piperidine-1-carboxylateSCHEMBL2972365OFQWTOOSUIGQBP-JGCGQSQUSA-NBDBM50268479
Database identifiers
- PubChem CID
- 11599798
- ChEMBL
CHEMBL499488
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 46
- Formal charge
- 0
- Complexity
- 1,170
Related reactions
1 records
Compound notes
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