Basic information
- CAS
101564-64-1- Standard SMILES
COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CCN3CCCCC3)C2=O)cc1.COc1ccc(C2(c3ccc(OC)cc3)NC(=O)N(CCN3CCCCC3)C2=O)cc1.O=S(=O)(O)O- InChIKey
DXKNEGUWQIBJCL-UHFFFAOYSA-N- Molecular formula
- C48H60N6O12S
- Average molar mass
- 945.1 g/mol
- Monoisotopic mass
- 944.39899254
Names & identifiers
- Preferred name
- Hydantoin, 5,5-bis(p-methoxyphenyl)-3-(2-piperidinoethyl)-, hemisulfate
- IUPAC
- bis(5,5-bis(4-methoxyphenyl)-3-(2-piperidin-1-ylethyl)imidazolidine-2,4-dione);sulfuric acid
- English name
- 5,5-bis(4-methoxyphenyl)-3-[2-(1-piperidyl)ethyl]imidazolidine-2,4-dio ne, sulfuric acid
- Molecular formula
- C48H60N6O12S
- Molecular weight
- 0
Names & synonyms
HYDANTOIN, 5,5-BIS(p-METHOXYPHENYL)-3-(2-PIPERIDINOETHYL)-, HEMISULFATE101564-64-15,5-Bis(p-methoxyphenyl)-3-(2-piperidinoethyl)hydantoin hemisulfateDTXSID401440133-beta-(1-Piperidino)etil-5,5-bis-(p-metossifenil)idantoina solfato [Italian]3-beta-(1-Piperidino)etil-5,5-bis-(p-metossifenil)idantoina solfatoRefChem:347935DTXCID3066504Sulfuric acid--5,5-bis(4-methoxyphenyl)-3-[2-(piperidin-1-yl)ethyl]imidazolidine-2,4-dione (1/2)5,5-Bis(4-methoxyphenyl)-3-(2-piperidin-1-ylethyl)imidazolidine-2,4-dione5,5-bis(4-methoxyphenyl)-3-[2-(1-piperidyl)ethyl]imidazolidine-2,4-dio ne, sulfuric acid
Database identifiers
- CAS
101564-64-1- PubChem CID
- 58520
- DTXSID
DTXSID40144013
Properties
Computed structural properties
- Topological polar surface area
- 225 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 14
- Rotatable bonds
- 14
- Heavy atoms
- 67
- Formal charge
- 0
- Complexity
- 678
Chemistry & industry
Suppliers1 total
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Related reactions
0 records
No reaction records under the current filter.
Compound notes
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