Basic information
- CAS
66619-75-8- Standard SMILES
O=C(O)COCC(=O)N1CCC(C(c2ccccc2)c2ccccc2)CC1- InChIKey
ZMYIPQJVDWOHNA-UHFFFAOYSA-N- Molecular formula
- C22H25NO4
- Average molar mass
- 367.4 g/mol
- Monoisotopic mass
- 367.17835828
Names & identifiers
- Preferred name
- Mcn 4308
- IUPAC
- 2-[2-(4-benzhydrylpiperidin-1-yl)-2-oxoethoxy]acetic acid
Names & synonyms
Mcn 430866619-75-8Mcn-4308Acetic acid, (2-(4-(diphenylmethyl)-1-piperidinyl)-2-oxoethoxy)-DTXSID00216785RefChem:156095DTXCID301392762-[2-(4-benzhydrylpiperidin-1-yl)-2-oxoethoxy]acetic acidorb2815310CHEMBL3277396SCHEMBL11353346ZMYIPQJVDWOHNA-UHFFFAOYSA-N
Show more names
T202400[2-(4-benzhydrylpiperidino)-2-oxoethoxy]acetic acid{2-[4-(Diphenylmethyl)piperidin-1-yl]-2-oxoethoxy}acetic acid
Database identifiers
- CAS
66619-75-8- PubChem CID
- 196442
- DTXSID
DTXSID00216785- ChEMBL
CHEMBL3277396
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 457
Related reactions
8 records
Compound notes
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