V2X3ZY96W5
Basic information
- CAS
117523-46-3- Standard SMILES
O=C(c1ccoc1)N(c1cccc2nsnc12)C1CCN(CCc2ccccc2)CC1- InChIKey
GQXSRXVMAXBIJK-UHFFFAOYSA-N- Molecular formula
- C24H24N4O2S
- Average molar mass
- 432.5 g/mol
- Monoisotopic mass
- 432.16199719
Names & identifiers
- Preferred name
- V2X3ZY96W5
- IUPAC
- N-(2,1,3-benzothiadiazol-4-yl)-N-[1-(2-phenylethyl)piperidin-4-yl]furan-3-carboxamide
Names & synonyms
V2X3ZY96W5OHM-3507UNII-V2X3ZY96W5CHEMBL162700117523-46-33-Furancarboxamide, N-2,1,3-benzothiadiazol-4-yl-N-(1-(2-phenylethyl)-4-piperidinyl)-N-2,1,3-Benzothiadiazol-4-yl-N-(1-(2-phenylethyl)-4-piperidinyl)-3-furancarboxamide2,1,3-Benzothiadiazole, 3-furancarboxamide deriv.SCHEMBL10466913BDBM50017406L002143Furan-3-carboxylic acid benzo[1,2,5]thiadiazol-4-yl-(1-phenethyl-piperidin-4-yl)-amide
Database identifiers
- CAS
117523-46-3- PubChem CID
- 9845693
- ChEMBL
CHEMBL162700- UNII
- V2X3ZY96W5
- Nikkaji
- J924.563D
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 90.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 594
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Compound notes
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