N-(4-bromophenyl)-4-[2-[(4-bromophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
Basic information
- CAS
6623-72-9- Standard SMILES
O=C(NCCN1CCN(C(=O)Nc2ccc(Br)cc2)CC1)Nc1ccc(Br)cc1- InChIKey
VWODXEHNEILFCI-UHFFFAOYSA-N- Molecular formula
- C20H23Br2N5O2
- Average molar mass
- 525.2 g/mol
- Monoisotopic mass
- 523.02185
Names & identifiers
- Preferred name
- N-(4-bromophenyl)-4-[2-[(4-bromophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
- IUPAC
- N-(4-bromophenyl)-4-[2-[(4-bromophenyl)carbamoylamino]ethyl]piperazine-1-carboxamide
Names & synonyms
6623-72-9NSC55442N-(4-bromophenyl)-4-[2-[(4-bromophenyl)carbamoylamino]ethyl]piperazine-1-carboxamideDTXSID80984738NSC-55442DS-001929N-(4-Bromophenyl)-N'-(2-{4-[(4-bromophenyl)carbamoyl]piperazin-1-yl}ethyl)carbamimidic acid
Database identifiers
- CAS
6623-72-9- PubChem CID
- 244512
- DTXSID
DTXSID80984738
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 76.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 529
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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