Altapizone - CAS 93277-96-4
Catalog: |
BB061275 |
Product Name: |
Altapizone |
CAS: |
93277-96-4 |
Synonyms: |
Altapizone; Altapizone [INN]; N-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-3-(4-phenylpiperidin-1-yl)propanamide; 4-Phenyl-4'-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)-1-piperidinepropionanilide; 4-Phenyl-N-[4-(1,4,5,6-tetrahydro-6-oxo-3-pyridazinyl)phenyl]-1-piperidinepropanamide |
IUPAC Name: | N-[4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenyl]-3-(4-phenylpiperidin-1-yl)propanamide |
Molecular Weight: | 404.50 |
Molecular Formula: | C24H28N4O2 |
Canonical SMILES: | C1CN(CCC1C2=CC=CC=C2)CCC(=O)NC3=CC=C(C=C3)C4=NNC(=O)CC4 |
InChI: | InChI=1S/C24H28N4O2/c29-23(14-17-28-15-12-19(13-16-28)18-4-2-1-3-5-18)25-21-8-6-20(7-9-21)22-10-11-24(30)27-26-22/h1-9,19H,10-17H2,(H,25,29)(H,27,30) |
InChI Key: | JQUDBRIUEIAJNQ-UHFFFAOYSA-N |
Complexity: | 613 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 404.22122615 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 404.22122615 |
Rotatable Bond Count: | 6 |
Topological Polar Surface Area: | 73.8Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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