200,000+ products from a single source!
sales@angenechem.com
Home > Other Building Blocks > 857531-75-0
857531-75-0 | Phenol, 4-[4-[4-(1H-pyrazol-4-yl)phenyl]-4-piperidinyl]-
CAS No: 857531-75-0 Catalog No: AG004OVS MDL No:
Product Description
Catalog Number:
AG004OVS
Chemical Name:
Phenol, 4-[4-[4-(1H-pyrazol-4-yl)phenyl]-4-piperidinyl]-
CAS Number:
857531-75-0
Molecular Formula:
C20H21N3O
Molecular Weight:
319.4002
IUPAC Name:
4-[4-[4-(1H-pyrazol-4-yl)phenyl]piperidin-4-yl]phenol
InChI:
InChI=1S/C20H21N3O/c24-19-7-5-18(6-8-19)20(9-11-21-12-10-20)17-3-1-15(2-4-17)16-13-22-23-14-16/h1-8,13-14,21,24H,9-12H2,(H,22,23)
InChI Key:
AOJCEFPPEOPJAD-UHFFFAOYSA-N
SMILES:
Oc1ccc(cc1)C1(CCNCC1)c1ccc(cc1)c1c[nH]nc1
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
319.168g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
3
Isotope Atom Count:
0
Molecular Weight:
319.408g/mol
Monoisotopic Mass:
319.168g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
60.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.