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Home Halogens (1S)-2-Amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol

(1S)-2-Amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol

CAS No.:
1056901-62-2
Catalog Number:
AG008TDL
Molecular Formula:
C17H16ClN3O
Molecular Weight:
313.7814
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$97
- +
5mg
≥98%
1 week
United States
$208
- +
10mg
≥98%
1 week
United States
$298
- +
25mg
≥98%
1 week
United States
$410
- +
100mg
99%
1 week
United States
$1369
- +
Product Description
Catalog Number:
AG008TDL
Chemical Name:
(1S)-2-Amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol
CAS Number:
1056901-62-2
Molecular Formula:
C17H16ClN3O
Molecular Weight:
313.7814
MDL Number:
MFCD25976789
IUPAC Name:
(1S)-2-amino-1-(4-chlorophenyl)-1-[4-(1H-pyrazol-4-yl)phenyl]ethanol
InChI:
InChI=1S/C17H16ClN3O/c18-16-7-5-15(6-8-16)17(22,11-19)14-3-1-12(2-4-14)13-9-20-21-10-13/h1-10,22H,11,19H2,(H,20,21)/t17-/m0/s1
InChI Key:
IIRWNGPLJQXWFJ-KRWDZBQOSA-N
SMILES:
NC[C@@](c1ccc(cc1)Cl)(c1ccc(cc1)c1c[nH]nc1)O
UNII:
A49037RP1E
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
313.098g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
313.785g/mol
Monoisotopic Mass:
313.098g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
74.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
AT13148 is a novel, oral multi-AGC kinase inhibitor with potent pharmacodynamic and antitumor activity. Clinical cancer research : an official journal of the American Association for Cancer Research 20120715
Properties