Completing data — usually done within a minute
Basic information
- CAS
132686-80-7- Standard SMILES
CN1C(=O)c2cccnc2N(CCO)c2ccccc21- InChIKey
WMKDCDDFJCFMMJ-UHFFFAOYSA-N- Molecular formula
- C15H15N3O2
- Average molar mass
- 269.3 g/mol
- Monoisotopic mass
- 269.11642673
Names & identifiers
- Preferred name
- N11-(2-Hydroxyethyl)-N6-methyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-one
- IUPAC
- 11-(2-hydroxyethyl)-6-methylpyrido[3,2-c][1,5]benzodiazepin-5-one
Names & synonyms
132686-80-7N11-(2-Hydroxyethyl)-N6-methyl-6,11-dihydro-5H-pyrido(2,3-b)(1,5)benzodiazepin-5-oneN11-(2-Hydroxyethyl)-N6-methyl-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepin-5-oneCHEMBL308491SCHEMBL8790036DTXSID90157698WMKDCDDFJCFMMJ-UHFFFAOYSA-N6,11-Dihydro-11-(2-hydroxyethyl)-6-methyl-5H-pyrido[2,3-b][1,5]benzodiazepin-5-one11-(2-hydroxyethyl)-6-methyl-pyrido[3,2-c][1,5]benzodiazepin-5-one11-(2-Hydroxyethyl)-6-methyl-6,11-dihydro-5H-pyrido[2,3-b][1,5]benzodiazepin-5-one
Database identifiers
- CAS
132686-80-7- PubChem CID
- 453261
- DTXSID
DTXSID90157698- ChEMBL
CHEMBL308491- Nikkaji
- J420.529D
Properties
Computed structural propertiesFilling in
- XLogP
- 1.3
- Topological polar surface area
- 56.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 363
Related reactions
2 records
Compound notes
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