Anthra[1,9-cd]pyrazol-6(2H)-one, 2-[2-(diethylamino)ethyl]-8,10-dimethoxy-4-methyl-
Basic information
- CAS
915065-95-1- Standard SMILES
CCN(CC)CCn1nc2c3c(cc(C)cc31)C(=O)c1cc(OC)cc(OC)c1-2- InChIKey
BCDXIIDXKVWEED-UHFFFAOYSA-N- Molecular formula
- C23H27N3O3
- Average molar mass
- 393.5 g/mol
- Monoisotopic mass
- 393.20524173
Names & identifiers
- Preferred name
- Anthra[1,9-cd]pyrazol-6(2H)-one, 2-[2-(diethylamino)ethyl]-8,10-dimethoxy-4-methyl-
- IUPAC
- 14-[2-(diethylamino)ethyl]-3,5-dimethoxy-11-methyl-14,15-diazatetracyclo[7.6.1.02,7.013,16]hexadeca-1(15),2(7),3,5,9(16),10,12-heptaen-8-one
Names & synonyms
CHEMBL243249DTXSID301130627Anthra[1,9-cd]pyrazol-6(2H)-one, 2-[2-(diethylamino)ethyl]-8,10-dimethoxy-4-methyl-915065-95-12-[2-(Diethylamino)ethyl]-8,10-dimethoxy-4-methyldibenzo[cd,g]indazol-6(2H)-one
Database identifiers
- CAS
915065-95-1- PubChem CID
- 16088366
- DTXSID
DTXSID301130627- ChEMBL
CHEMBL243249
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 584
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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