Ethyl 1,2,3,4-tetrahydro-4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-5-pyrimidinecarboxylate
Basic information
- CAS
303136-83-6- Standard SMILES
CCOC(=O)C1=C(C)NC(=O)NC1c1ccc(OCCO)c(OC)c1- InChIKey
SXNVZBOFKSCUFB-UHFFFAOYSA-N- Molecular formula
- C17H22N2O6
- Average molar mass
- 350.4 g/mol
- Monoisotopic mass
- 350.14778643
Names & identifiers
- Preferred name
- Ethyl 1,2,3,4-tetrahydro-4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-5-pyrimidinecarboxylate
- IUPAC
- ethyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate
Names & synonyms
303136-83-6Ethyl 1,2,3,4-tetrahydro-4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-5-pyrimidinecarboxylateEthyl 1,2,3,4-tetrahydro-4-(4-(2-hydroxyethoxy)-3-methoxyphenyl)-6-methyl-2-oxo-5-pyrimidinecarboxylateRefChem:341865ethyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydro-5-pyrimidinecarboxylateethyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-1,2,3,4-tetrahydropyrimidine-5-carboxylateSMR000104004MLS000108041Oprea1_453535Oprea1_843770MLS002539971CHEMBL1375697
Show more names
DTXSID701111994HMS2184P03STK087683AKOS000655225AKOS022079525NCGC00080586-02ethyl 4-[4-(2-hydroxyethoxy)-3-methoxyphenyl]-6-methyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylateAK-968/11532010
Database identifiers
- CAS
303136-83-6- PubChem CID
- 2863237
- DTXSID
DTXSID701111994- ChEMBL
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 106 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 521
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Compound notes
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