Methyl 2-{3-[3-(dimethylcarbamoyl)phenyl]phenyl}acetate
Basic information
- CAS
1820620-32-3- Standard SMILES
COC(=O)Cc1cccc(-c2cccc(C(=O)N(C)C)c2)c1- InChIKey
QNEYWHXCFMDIGU-UHFFFAOYSA-N- Molecular formula
- C18H19NO3
- Average molar mass
- 297.3 g/mol
- Monoisotopic mass
- 297.13649347
Names & identifiers
- Preferred name
- Methyl 2-{3-[3-(dimethylcarbamoyl)phenyl]phenyl}acetate
- IUPAC
- methyl 2-[3-[3-(dimethylcarbamoyl)phenyl]phenyl]acetate
Names & synonyms
1820620-32-3methyl 2-{3-[3-(dimethylcarbamoyl)phenyl]phenyl}acetatemethyl 2-[3-[3-(dimethylcarbamoyl)phenyl]phenyl]acetateDTXSID201146316methyl2-{3-[3-(dimethylcarbamoyl)phenyl]phenyl}acetateMethyl [3'-(dimethylcarbamoyl)[1,1'-biphenyl]-3-yl]acetate[1,1a(2)-Biphenyl]-3-acetic acid, 3a(2)-[(dimethylamino)carbonyl]-, methyl ester
Database identifiers
- CAS
1820620-32-3- PubChem CID
- 75488296
- DTXSID
DTXSID201146316
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 394
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Compound notes
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