3,8-diethyl-N-(2-methoxyphenyl)-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
Basic information
- CAS
1189668-70-9- Standard SMILES
CCn1c(=O)c2c(C(=O)Nc3ccccc3OC)cc(=O)n(CC)c2n(C)c1=O- InChIKey
BWHIZFSLYUEJSE-UHFFFAOYSA-N- Molecular formula
- C20H22N4O5
- Average molar mass
- 398.4 g/mol
- Monoisotopic mass
- 398.15901982
Names & identifiers
- Preferred name
- 3,8-diethyl-N-(2-methoxyphenyl)-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamide
- IUPAC
- 3,8-diethyl-N-(2-methoxyphenyl)-1-methyl-2,4,7-trioxopyrido[2,3-d]pyrimidine-5-carboxamide
Names & synonyms
1189668-70-93,8-diethyl-N-(2-methoxyphenyl)-1-methyl-2,4,7-trioxo-1,2,3,4,7,8-hexahydropyrido[2,3-d]pyrimidine-5-carboxamideDTXSID301107620HMS3496K15AKOS0218209623,8-DIETHYL-N-(2-METHOXYPHENYL)-1-METHYL-2,4,7-TRIOXOPYRIDO[2,3-D]PYRIMIDINE-5-CARBOXAMIDE3,8-Diethyl-1,2,3,4,7,8-hexahydro-N-(2-methoxyphenyl)-1-methyl-2,4,7-trioxopyrido[2,3-d]pyrimidine-5-carboxamide3,8-DIETHYL-N-(2-METHOXYPHENYL)-1-METHYL-2,4,7-TRIOXO-1H,2H,3H,4H,7H,8H-PYRIDO[2,3-D]PYRIMIDINE-5-CARBOXAMIDE
Database identifiers
- CAS
1189668-70-9- PubChem CID
- 53006458
- DTXSID
DTXSID301107620
Properties
Computed structural properties
- XLogP
- 0.5
- Topological polar surface area
- 99.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 803
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Compound notes
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