6- [1- [(2, 3- Difluorophenyl) methyl] - 4- piperidinyl] - 2- (2- pyridinyl) -4(3H) - pyrimidinone - CAS 1381465-50-4
Catalog: |
BB067716 |
Product Name: |
6- [1- [(2, 3- Difluorophenyl) methyl] - 4- piperidinyl] - 2- (2- pyridinyl) -4(3H) - pyrimidinone |
CAS: |
1381465-50-4 |
Synonyms: |
6-(1-(2,3-Difluorobenzyl)piperidin-4-yl)-2-(pyridin-2-yl)pyrimidin-4(3H)-one; 4-[1-[(2,3-difluorophenyl)methyl]piperidin-4-yl]-2-pyridin-2-yl-1H-pyrimidin-6-one |
IUPAC Name: | 4-[1-[(2,3-difluorophenyl)methyl]piperidin-4-yl]-2-pyridin-2-yl-1H-pyrimidin-6-one |
Description: | 6- [1- [(2, 3- Difluorophenyl) methyl] - 4- piperidinyl] - 2- (2- pyridinyl) -4(3H) - pyrimidinone is a useful chemical of research. |
Molecular Weight: | 382.41 |
Molecular Formula: | C21H20F2N4O |
Canonical SMILES: | C1CN(CCC1C2=CC(=O)NC(=N2)C3=CC=CC=N3)CC4=C(C(=CC=C4)F)F |
InChI: | InChI=1S/C21H20F2N4O/c22-16-5-3-4-15(20(16)23)13-27-10-7-14(8-11-27)18-12-19(28)26-21(25-18)17-6-1-2-9-24-17/h1-6,9,12,14H,7-8,10-11,13H2,(H,25,26,28) |
InChI Key: | HGJNIPRGQNBUDZ-UHFFFAOYSA-N |
Complexity: | 630 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 382.1605176 |
Formal Charge: | 0 |
Heavy Atom Count: | 28 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 382.1605176 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 57.6Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.5 |
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