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(4S)-1-(4-methoxyphenyl)-2'-[(2R)-1-(4-methoxyphenyl)-3,3-dimethyl-4-oxoazetidin-2-yl]oxy-3,3-dimethylspiro[azetidine-4,3'-indole]-2-one

HCID 178587809
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Basic information

CAS
896746-39-7
Standard SMILES
COc1ccc(N2C(=O)C(C)(C)[C@H]2OC2=Nc3ccccc3[C@@]23N(c2ccc(OC)cc2)C(=O)C3(C)C)cc1
InChIKey
FNQRBUABROTMCJ-GRKNLSHJSA-N
Molecular formula
C31H31N3O5
Average molar mass
525.6 g/mol
Monoisotopic mass
525.2263711

Names & identifiers

Preferred name
(4S)-1-(4-methoxyphenyl)-2'-[(2R)-1-(4-methoxyphenyl)-3,3-dimethyl-4-oxoazetidin-2-yl]oxy-3,3-dimethylspiro[azetidine-4,3'-indole]-2-one
IUPAC
(4S)-1-(4-methoxyphenyl)-2'-[(2R)-1-(4-methoxyphenyl)-3,3-dimethyl-4-oxoazetidin-2-yl]oxy-3,3-dimethylspiro[azetidine-4,3'-indole]-2-one
English name
(S)-1-(4-METHOXYPHENYL)-2'-((R)-1-(4-METHOXYPHENYL)-3,3-DIMETHYL-4-OXOAZETIDIN-2-YLOXY)-3,3-DIMETHYLSPIRO[AZETIDINE-2,3'-INDOL]-4-ONE
Molecular formula
C31H31N3O5
Molecular weight
0

Names & synonyms

(S)-1-(4-METHOXYPHENYL)-2'-((R)-1-(4-METHOXYPHENYL)-3,3-DIMETHYL-4-OXOAZETIDIN-2-YLOXY)-3,3-DIMETHYLSPIRO[AZETIDINE-2,3'-INDOL]-4-ONE

Database identifiers

CAS
896746-39-7
PubChem CID
11613379
Nikkaji
J2.344.612J

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
80.7 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
39
Formal charge
0
Complexity
1,010

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