Ethyl (6-chloro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetate
Basic information
- CAS
40889-45-0- Standard SMILES
CCOC(=O)Cn1c(C)nc2ccc(Cl)cc2c1=O- InChIKey
JBXJYVVHWZCMMN-UHFFFAOYSA-N- Molecular formula
- C13H13ClN2O3
- Average molar mass
- 280.7 g/mol
- Monoisotopic mass
- 280.06147
Names & identifiers
- Preferred name
- Ethyl (6-chloro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetate
- IUPAC
- ethyl 2-(6-chloro-2-methyl-4-oxoquinazolin-3-yl)acetate
Names & synonyms
40889-45-0DTXSID00961283Ethyl (6-chloro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetateRefChem:1084687DTXCID601389114Ethyl 2-(6-chloro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetate6-Chloro-2-methyl-4-oxo-3(4H)-quinazolineacetic acid ethyl esterethyl 2-(6-chloro-2-methyl-4-oxoquinazolin-3-yl)acetateethyl 2-(6-chloro-2-methyl-4-oxo-3,4-dihydroquinazolin-3-yl)acetateethyl 2-[6-chloro-2-methyl-4-oxo-3(4H)-quinazolinyl]acetate3(4H)-Quinazolineacetic acid, 6-chloro-2-methyl-4-oxo-, ethyl esterAKOS005107291
Show more names
MS-0418SR-01000309766SR-01000309766-1Ethyl2-(6-chloro-2-methyl-4-oxoquinazolin-3(4H)-yl)acetate
Database identifiers
- CAS
40889-45-0- PubChem CID
- 218586
- DTXSID
DTXSID00961283
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 411
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Related reactions
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Compound notes
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