1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-methyl-3-oxo-, ethyl ester
Completing data — refresh the page later to see the latest
Basic information
- CAS
108734-80-1- Standard SMILES
CCOC(=O)C(C)n1nc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)nc1=O- InChIKey
IDHLTDILBLXCDR-UHFFFAOYSA-N- Molecular formula
- C22H23N3O5
- Average molar mass
- 409.4 g/mol
- Monoisotopic mass
- 409.16377084
Names & identifiers
- Preferred name
- 1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-methyl-3-oxo-, ethyl ester
- IUPAC
- ethyl 2-[5,6-bis(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]propanoate
- English name
- 1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-methy l-3-oxo-, ethyl ester
- Molecular weight
- 0
Names & synonyms
108734-80-12-(1-Ethoxycarbonyl-1-ethyl)-3-oxo-5,6-di(paramethoxyphenyl)-as-triazineEthyl 5,6-bis(4-methoxyphenyl)-alpha-methyl-3-oxo-1,2,4-triazine-2(3H)-acetate1,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-methyl-3-oxo-, ethyl esterRefChem:215046ethyl 2-[5,6-bis(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2-yl]propanoateDTXSID109108431,2,4-Triazine-2(3H)-acetic acid, 5,6-bis(4-methoxyphenyl)-alpha-methy l-3-oxo-, ethyl esterEthyl 2-[5,6-bis(4-methoxyphenyl)-3-oxo-1,2,4-triazin-2(3H)-yl]propanoate
Database identifiers
- CAS
108734-80-1- PubChem CID
- 3065745
- DTXSID
DTXSID10910843
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 89.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 676
Related reactions
0 records
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Compound notes
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