N11-Cyclopropyl-7-hydroxy-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
Basic information
- CAS
133627-33-5- Standard SMILES
Cc1ccnc2c1NC(=O)c1c([nH]ccc1=O)N2C1CC1- InChIKey
IUXQNPCHCAMRPU-UHFFFAOYSA-N- Molecular formula
- C15H14N4O2
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.1116757
Names & identifiers
- Preferred name
- N11-Cyclopropyl-7-hydroxy-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-one
- IUPAC
- 2-cyclopropyl-7-methyl-2,4,9,15-tetrazatricyclo[9.4.0.03,8]pentadeca-1(11),3,5,7,13-pentaene-10,12-dione
Names & synonyms
133627-33-5N11-Cyclopropyl-7-hydroxy-4-methyl-5,11-dihydro-6H-dipyrido[3,2-b:2',3'-e][1,4]diazepin-6-oneN11-Cyclopropyl-7-hydroxy-4-methyl-5,11-dihydro-6H-dipyrido(3,2-b:2',3'-e)(1,4)diazepin-6-oneCHEMBL72225DTXSID5092822011-Cyclopropyl-4-methyl-11H-dipyrido[3,2-b:2',3'-e][1,4]diazepine-6,7-diol11-cyclopropyl-7-hydroxy-4-methyl-5H-dipyrido[[?],[?]][1,4]diazepin-6-one
Database identifiers
- CAS
133627-33-5- PubChem CID
- 453347
- DTXSID
DTXSID50928220- ChEMBL
CHEMBL72225- Nikkaji
- J420.616I
Properties
Computed structural properties
- XLogP
- 1.3
- Topological polar surface area
- 74.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 564
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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