11H-Pyrido(2,3-b)(1,4)benzodiazepine-11-carboxamide, N-(2-(2-((dipropylamino)methyl)-1-piperidinyl)ethyl)-5,6-dihydro-6-oxo-, methanesulfonate (1:1)
Basic information
- CAS
118290-27-0- Standard SMILES
CCCN(CCC)CC1CCCCN1CCNC(=O)N1c2ccccc2C(=O)Nc2cccnc21.CS(=O)(=O)O- InChIKey
LBXOPAJGAXATCZ-UHFFFAOYSA-N- Molecular formula
- C28H42N6O5S
- Average molar mass
- 574.7 g/mol
- Monoisotopic mass
- 574.29373964
Overview
structure given in first source
Names & identifiers
- Preferred name
- 11H-Pyrido(2,3-b)(1,4)benzodiazepine-11-carboxamide, N-(2-(2-((dipropylamino)methyl)-1-piperidinyl)ethyl)-5,6-dihydro-6-oxo-, methanesulfonate (1:1)
- IUPAC
- N-[2-[2-[(dipropylamino)methyl]piperidin-1-yl]ethyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide;methanesulfonic acid
- English name
- AF-DX 384
- Molecular formula
- C27H38N6O2.CH4O3S
- Molecular weight
- 574.74
Names & synonyms
118290-27-0Afdx 38411H-Pyrido(2,3-b)(1,4)benzodiazepine-11-carboxamide, N-(2-(2-((dipropylamino)methyl)-1-piperidinyl)ethyl)-5,6-dihydro-6-oxo-, monomethanesulfonate11H-Pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide, N-[2-[2-[(dipropylamino)methyl]-1-piperidinyl]ethyl]-5,6-dihydro-6-oxo-, methanesulfonate (1:1)11H-Pyrido(2,3-b)(1,4)benzodiazepine-11-carboxamide, N-(2-(2-((dipropylamino)methyl)-1-piperidinyl)ethyl)-5,6-dihydro-6-oxo-, methanesulfonate (1:1)RefChem:2363325,11-Dihydro-11-(((2-(2-((dipropylamino)methyl)-1-piperidinyl)ethyl)amino)carbonyl)-6H-pyrido(2,3-b)(1,4)-benzodiazepin-6-one methanesulfonateN-[2-[2-[(dipropylamino)methyl]piperidin-1-yl]ethyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide;methanesulfonic acidAF-DX 384 (methanesulfonate)af-dx384AFDX384 MesylateCHEMBL113188
Show more names
AF-DX 384AF-DX 384 methanesulfonateAF-DX 384, M2/M4 antagonistN-(2-(2-((DIPROPYLAMINO)METHYL)PIPERIDIN-1-YL)ETHYL)-6-OXO-5H-BENZO[E]PYRIDO[3,2-B][1,4]DIAZEPINE-11(6H)-CARBOXAMIDE
Properties
Computed structural properties
- Topological polar surface area
- 144 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 9
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 777
Physicochemical properties
- storage temp.
- Store at RT
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationAgents that inhibit the actions of the parasympathetic nervous system. The major group of drugs used therapeutically for this purpose is the MUSCARINIC ANTAGONISTS.
Applications
UsesAF-DX 384 is a potent mAChR M2/mAChR M4selective antagonist.
Additional notes
DefinitionChEBI: N-[2-[2-[(dipropylamino)methyl]-1-piperidinyl]ethyl]-6-oxo-5H-pyrido[2,3-b][1,4]benzodiazepine-11-carboxamide is a benzodiazepine.
Related reactions
1 records
Compound notes
Loading…