200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 1624260-69-0
1624260-69-0 | 4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,3a,5,6-tetrahydro-6-[1-(phenylmethyl)-2-piperidinyl]-1-(tetrahydro-2H-pyran-4-yl)-
CAS No: 1624260-69-0 Catalog No: AG001T3S MDL No:
Product Description
Catalog Number:
AG001T3S
Chemical Name:
4H-Pyrazolo[3,4-d]pyrimidin-4-one, 1,3a,5,6-tetrahydro-6-[1-(phenylmethyl)-2-piperidinyl]-1-(tetrahydro-2H-pyran-4-yl)-
CAS Number:
1624260-69-0
Molecular Formula:
C22H29N5O2
Molecular Weight:
395.4980
IUPAC Name:
6-(1-benzylpiperidin-2-yl)-1-(oxan-4-yl)-5,6-dihydro-3aH-pyrazolo[3,4-d]pyrimidin-4-one
InChI:
InChI=1S/C22H29N5O2/c28-22-18-14-23-27(17-9-12-29-13-10-17)21(18)24-20(25-22)19-8-4-5-11-26(19)15-16-6-2-1-3-7-16/h1-3,6-7,14,17-20H,4-5,8-13,15H2,(H,25,28)
InChI Key:
PQYURWIRBUDGPO-UHFFFAOYSA-N
SMILES:
O=C1NC(N=C2C1C=NN2C1CCOCC1)C1CCCCN1Cc1ccccc1
Properties
Complexity:
654
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
395.232g/mol
Formal Charge:
0
Heavy Atom Count:
29
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
395.507g/mol
Monoisotopic Mass:
395.232g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
69.5A^2
Undefined Atom Stereocenter Count:
3
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
Related Products
© 2019 Angene International Limited. All rights Reserved.