Basic information
- CAS
106626-72-6- Standard SMILES
Cc1cccc2cc3cccc(C(=O)NCCN(C)C)c3nc12- InChIKey
OMODTYNMXWHFBD-UHFFFAOYSA-N- Molecular formula
- C19H21N3O
- Average molar mass
- 307.4 g/mol
- Monoisotopic mass
- 307.1684623
Overview
structure in first source
Names & identifiers
- Preferred name
- N-(2-(Dimethylamino)ethyl)-5-methyl-4-acridinecarboxamide
- IUPAC
- N-[2-(dimethylamino)ethyl]-5-methylacridine-4-carboxamide
- English name
- N-(2-(dimethylamino)ethyl)-5-methyl-4-acridinecarboxamide
- Molecular formula
- C19H21N3O
- Molecular weight
- 307.39
Names & synonyms
106626-72-6Daem-acridinecarboxamideN-(2-(Dimethylamino)ethyl)-5-methyl-4-acridinecarboxamideDTXSID30147694RefChem:161611DTXCID7070185N-[2-(DIMETHYLAMINO)ETHYL]-5-METHYLACRIDINE-4-CARBOXAMIDEN-(2-(Dimethylamino)ethyl)-5-methylacridine-4-carboxamideCHEMBL29602NCI60_0053774-Acridinecarboxamide, N-(2-(dimethylamino)ethyl)-5-methyl-4-Acridinecarboxamide, N-[2-(dimethylamino)ethyl]-5-methyl-
Database identifiers
- CAS
106626-72-6- PubChem CID
- 129384
- DTXSID
DTXSID30147694- ChEMBL
CHEMBL29602- Nikkaji
- J847.981J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 45.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 411
Chemistry & industry
Pharmacology
MeSH Pharmacological Classification
Compounds that inhibit the activity of DNA TOPOISOMERASE II. Included in this category are a variety of ANTINEOPLASTIC AGENTS which target the eukaryotic form of topoisomerase II and ANTIBACTERIAL AGENTS which target the prokaryotic form of topoisomerase II.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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