200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 893422-47-4
893422-47-4 | 3-Phenyl-2-[4-[[4-[5-(2-pyridinyl)-1H-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]phenyl]-1,6-Naphthyridin-5(6H)-one
CAS No: 893422-47-4 Catalog No: AG00GU7Y MDL No:
Product Description
Catalog Number:
AG00GU7Y
Chemical Name:
3-Phenyl-2-[4-[[4-[5-(2-pyridinyl)-1H-1,2,4-triazol-3-yl]-1-piperidinyl]methyl]phenyl]-1,6-Naphthyridin-5(6H)-one
CAS Number:
893422-47-4
Molecular Formula:
C33H29N7O
Molecular Weight:
539.6297
IUPAC Name:
3-phenyl-2-[4-[[4-(3-pyridin-2-yl-1H-1,2,4-triazol-5-yl)piperidin-1-yl]methyl]phenyl]-6H-1,6-naphthyridin-5-one
InChI:
InChI=1S/C33H29N7O/c41-33-27-20-26(23-6-2-1-3-7-23)30(36-28(27)13-17-35-33)24-11-9-22(10-12-24)21-40-18-14-25(15-19-40)31-37-32(39-38-31)29-8-4-5-16-34-29/h1-13,16-17,20,25H,14-15,18-19,21H2,(H,35,41)(H,37,38,39)
InChI Key:
BTUWHHFNOHVCMQ-UHFFFAOYSA-N
SMILES:
O=c1[nH]ccc2c1cc(c1ccccc1)c(n2)c1ccc(cc1)CN1CCC(CC1)c1[nH]nc(n1)c1ccccn1
Properties
Complexity:
892
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
539.243g/mol
Formal Charge:
0
Heavy Atom Count:
41
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
539.643g/mol
Monoisotopic Mass:
539.243g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
99.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
Literature
| Title | Journal |
|---|---|
| Allosteric inhibitors of Akt1 and Akt2: discovery of [1,2,4]triazolo[3,4-f][1,6]naphthyridines with potent and balanced activity. | Bioorganic & medicinal chemistry letters 20090201 |
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.