Basic information
- CAS
126581-74-6- Standard SMILES
Cc1c(CN(C)C)c2c(n1Cc1ccccc1)C(=O)c1ccc(Br)cc1-2- InChIKey
DGDOAYXAWGZZMH-UHFFFAOYSA-N- Molecular formula
- C22H21BrN2O
- Average molar mass
- 409.3 g/mol
- Monoisotopic mass
- 408.08373
Names & identifiers
- Preferred name
- Indeno(2,1-b)pyrrol-8(1H)-one, 5-bromo-3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)-
- IUPAC
- 3-benzyl-7-bromo-1-[(dimethylamino)methyl]-2-methylindeno[2,3-b]pyrrol-4-one
Names & synonyms
126581-74-6BRN 4237773Indeno(2,1-b)pyrrol-8(1H)-one, 5-bromo-3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)-DTXSID101552375-Bromo-3-((dimethylamino)methyl)-2-methyl-1-(phenylmethyl)indeno(2,1-b)pyrrol-8(1H)-oneIndeno[2,1-b]pyrrol-8(1H)-one, 5-bromo-3-[(dimethylamino)methyl]-2-methyl-1-(phenylmethyl)-RefChem:349092DTXCID0077728Indeno[2,1-b]pyrrol-8(1H)-one,5-bromo-3-[(dimethylamino)methyl]-2-methyl-1-(phenylmethyl)-1-benzyl-5-bromo-3-[(dimethylamino)methyl]-2-methylindeno[2,1-b]pyrrol-8(1H)-one1-Benzyl-5-bromo-3-dimethylaminomethyl-2-methyl-1H-indeno[2,1-b]pyrrol-8-oneMLS000557541
Show more names
SMR000148457ChemDiv3_0145323-benzyl-7-bromo-1-[(dimethylamino)methyl]-2-methylindeno[2,3-b]pyrrol-4-oneCHEMBL1620132SCHEMBL13856611BDBM40685cid_9551808HMS1514E12
Database identifiers
- CAS
126581-74-6
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 25.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 518
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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