Basic information
- CAS
50840-26-1- Standard SMILES
Cc1nc2ccccc2c(=O)n1CCOC(=O)COc1ccc(Cl)cc1- InChIKey
IMHBOKLSYFLOKS-UHFFFAOYSA-N- Molecular formula
- C19H17ClN2O4
- Average molar mass
- 372.8 g/mol
- Monoisotopic mass
- 372.0876847
Names & identifiers
- Preferred name
- Acetic acid, p-chlorophenoxy-, 2-(2-methyl-4-oxo-3,4-dihydro-3-quinazolinyl)ethyl ester
- IUPAC
- 2-(2-methyl-4-oxoquinazolin-3-yl)ethyl 2-(4-chlorophenoxy)acetate
- English name
- p-Chlorophenoxyacetic acid 2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)ethyl ester
- Molecular formula
- C19H17ClN2O4
- Molecular weight
- 372.8
Names & synonyms
BRN 084708750840-26-1Acetic acid, p-chlorophenoxy-, 2-(2-methyl-4-oxo-3,4-dihydro-3-quinazolinyl)ethyl esterDTXSID401988793-(2-Hydroxyethyl)-2-methyl-4(3H)-quinazolinone (p-chlorophenoxy)acetate4(3H)-Quinazolinone, 3-(2-hydroxyethyl)-2-methyl-, (p-chlorophenoxy)acetateRefChem:316674DTXCID501213702-(2-Methyl-4-oxoquinazolin-3(4H)-yl)ethyl (4-chlorophenoxy)acetateAcetic acid, 2-(4-chlorophenoxy)-, 2-(2-methyl-4-oxo-3(4H)-quinazolinyl)ethyl esterp-Chlorophenoxyacetic acid 2-(2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)ethyl ester
Database identifiers
- CAS
50840-26-1- PubChem CID
- 39828
- DTXSID
DTXSID40198879- Nikkaji
- J79.204G
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 68.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 546
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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