Basic information
- Standard SMILES
O=C(NC(=O)c1ccccc1)NC1CCN(Cc2ccc3ccccc3c2)CC1- InChIKey
AQFFJGJVFJCQQL-UHFFFAOYSA-N- Molecular formula
- C24H25N3O2
- Average molar mass
- 387.5 g/mol
- Monoisotopic mass
- 387.19467704
Overview
Panuramine is a small molecule drug. Panuramine has a monoisotopic molecular weight of 387.19 Da.
Names & identifiers
- Preferred name
- N-(((1-(2-Naphthalenylmethyl)-4-piperidinyl)amino)carbonyl)benzamide
- IUPAC
- N-[[1-(naphthalen-2-ylmethyl)piperidin-4-yl]carbamoyl]benzamide
- English name
- Panuramine
- Molecular formula
- C24H25N3O2
- Molecular weight
- 387.47
Names & synonyms
PanuraminePanuramina80349-58-2Panuraminum1UWS3T8EABDTXSID302302571-Benzoyl-3-(1-(2-naphthylmethyl)-4-piperidyl)ureaRefChem:926511DTXCID30152748Wy-26002N-(((1-(2-Naphthalenylmethyl)-4-piperidinyl)amino)carbonyl)benzamidePanuraminum [Latin]
Show more names
Benzamide, N-[[[1-(2-naphthalenylmethyl)-4-piperidinyl]amino]carbonyl]-
Panuramina [Spanish]Panuramine [INN:BAN]UNII-1UWS3T8EABPANURAMINE [INN]orb1740810SCHEMBL2037759SCHEMBL9593017CHEMBL2105324
Database identifiers
- CAS
80349-58-2- PubChem CID
- 72002
- DTXSID
DTXSID30230257- ChEMBL
CHEMBL2105324- UNII
- 1UWS3T8EAB
- Nikkaji
- J126.242D
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 552
Physicochemical properties
- FDA UNII
- 1 UWS3T8EAB · 1UWS3T8EAB
Chemistry & industry
Suppliers3 total
湖北扬信医药科技有限公司0714-3999001 19171453112 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国(陶术生物)15002134094 · [email protected]
Related reactions
14 records
Linked notes
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