Grundinformationen
- Standard-SMILES
CCOC(=O)N1CCc2c(c3cccc4c3n2CC(=O)N4)C1- InChIKey
IIOWSVKQLNZUKM-UHFFFAOYSA-N- Summenformel
- C16H17N3O3
- Durchschnittliche Molmasse
- 299,32 g/mol
- Monoisotopische Masse
- 299,12699141
Namen und Bezeichner
- Bevorzugter Name
- Lumat-004
- IUPAC
- ethyl 3-oxo-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10(15)-tetraene-12-carboxylate
- Englischer Name
- LUMAT-004
- Summenformel
- C16H17N3O3
- Molmasse
- 299.32
Namen und Synonyme
313544-31-9LUMAT-004ethyl 2-oxo-2,3,9,10-tetrahydro-1H-pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylateEthyl 3-oxo-1,4,12-triazatetracyclo[7.6.1.05,16.010,15]hexadeca-5,7,9(16),10(15)-tetraene-12-carboxylate1H-Pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylic acid, 2,3,9,10-tetrahydro-2-oxo-, ethyl esterCK9RXD8FYRLumateperone Impurity N2SCHEMBL5510632IIOWSVKQLNZUKM-UHFFFAOYSA-Nethyl 2,3,9,10-tetrahydro-2-oxo-1H-pyrido[3',4':4,5]-pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylateEthyl 2,3,9,10-tetrahydro-2-oxo-1H-pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylateethyl-2-oxo-2,3,9,10-tetrahydro-1H-pyrido[3',4':4,5]-pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylate
Weitere Namen anzeigen
Lumateperone Impurity 12-Oxo-2,3,9,10-tetrahydro-1H,7H-pyrido-[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline-8-carboxylic Acid Ethyl Esterethyl 2,3,9,10-tetrahydro-2-oxo-1H-pyrido[3,4:4,5]-pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylateQ: What is ethyl 2,3,9,10-tetrahydro-2-oxo-1H-pyrido[3,4:4,5]-pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylate Q: What is the CAS Number of ethyl 2,3,9,10-tetrahydro-2-oxo-1H-pyrido[3,4:4,5]-pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylate
ethyl2-oxo-2,3,9,10-tetrahydro-1H-pyrido[3',4':4,5]pyrrolo[1,2,3-de]quinoxaline-8(7H)-carboxylate
Datenbank-Bezeichner
- CAS
313544-31-9- PubChem CID
- 22036738
- UNII
- CK9RXD8FYR
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 1,2
- Polarare Oberfläche (TPSA)
- 63,6 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 22
- Formalladung
- 0
- Komplexität
- 483
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