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Basic information
- CAS
81087-59-4- Standard SMILES
CCOC(=O)c1c(C)cc2[nH]c(=O)n(-c3ccccc3Cl)c(=O)c2c1C- InChIKey
OXCXKEZEDIDQSV-UHFFFAOYSA-N- Molecular formula
- C19H17ClN2O4
- Average molar mass
- 372.8 g/mol
- Monoisotopic mass
- 372.0876847
Names & identifiers
- Preferred name
- 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4(1H,3H)-quinazolidinedione
- IUPAC
- ethyl 3-(2-chlorophenyl)-5,7-dimethyl-2,4-dioxo-1H-quinazoline-6-carboxylate
- English name
- 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4(1H,3H)-quinazolidinedione
- Molecular formula
- C19H17ClN2O4
- Molecular weight
- 372.80228
Names & synonyms
3-Cedqd81087-59-43-(2-Chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4(1H,3H)-quinazolidinedioneRefChem:92181ethyl 3-(2-chlorophenyl)-5,7-dimethyl-2,4-dioxo-1H-quinazoline-6-carboxylateSCHEMBL11024247OXCXKEZEDIDQSV-UHFFFAOYSA-NDTXSID7010017633-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-(1H,3H)-quinazolinedione3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4(1H, 3H)-quinazolinedione3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-(1H, 3H)-quinazolinedioneEthyl 3-(2-chlorophenyl)-2-hydroxy-5,7-dimethyl-4-oxo-3,4-dihydroquinazoline-6-carboxylate
Show more names
6-Quinazolinecarboxylic acid, 3-(2-chlorophenyl)-1,2,3,4-tetrahydro-5,7-dimethyl-2,4-dioxo-, ethyl ester
Database identifiers
Properties
Computed structural propertiesFilling in
- XLogP
- 3.8
- Topological polar surface area
- 75.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 584
Related reactions
6 records
Compound notes
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