1-Piperazinepropionamide, 4-(2-(diphenylmethoxy)ethyl)-, dihydrochloride, sesquihydrate
Basic information
- CAS
61897-43-6- Standard SMILES
Cl.Cl.NC(=O)CCN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1- InChIKey
BICFPEIAFSLORP-UHFFFAOYSA-N- Molecular formula
- C22H31Cl2N3O2
- Average molar mass
- 440.4 g/mol
- Monoisotopic mass
- 439.1793326
Names & identifiers
- Preferred name
- 1-Piperazinepropionamide, 4-(2-(diphenylmethoxy)ethyl)-, dihydrochloride, sesquihydrate
- IUPAC
- 3-[4-(2-benzhydryloxyethyl)piperazin-1-yl]propanamide;dihydrochloride
Names & synonyms
1-Piperazinepropionamide, 4-(2-(diphenylmethoxy)ethyl)-, dihydrochloride, sesquihydrate4-(2-(Diphenylmethoxy)ethyl)-1-piperazinepropionamide dihydrochloride sesquihydrate61897-43-6DTXSID102109161-Piperazinepropanamide, 4-(2-(diphenylmethoxy)ethyl)-, hydrochloride, hydrate (2:4:3)RefChem:234095DTXCID401334073-{4-[2-(Diphenylmethoxy)ethyl]piperazin-1-yl}propanamide--hydrogen chloride (1/2)
Database identifiers
- CAS
61897-43-6- PubChem CID
- 3046277
- DTXSID
DTXSID10210916
Properties
Computed structural properties
- Topological polar surface area
- 58.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 407
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Related reactions
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Compound notes
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