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Home Other Building Blocks Hg-14-10-04

Hg-14-10-04

CAS No.:
1356962-34-9
Catalog Number:
AG009CC9
Molecular Formula:
C29H34ClN7O
Molecular Weight:
532.0796
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$105
- +
5mg
98%
1 week
United States
$265
- +
10mg
98%
1 week
United States
$404
- +
50mg
98%
1 week
United States
$682
- +
100mg
98%
1 week
United States
$960
- +
Product Description
Catalog Number:
AG009CC9
Chemical Name:
Hg-14-10-04
CAS Number:
1356962-34-9
Molecular Formula:
C29H34ClN7O
Molecular Weight:
532.0796
MDL Number:
MFCD28167799
IUPAC Name:
5-chloro-4-(1H-indol-3-yl)-N-[2-methoxy-4-[4-(4-methylpiperazin-1-yl)piperidin-1-yl]phenyl]pyrimidin-2-amine
InChI:
InChI=1S/C29H34ClN7O/c1-35-13-15-37(16-14-35)20-9-11-36(12-10-20)21-7-8-26(27(17-21)38-2)33-29-32-19-24(30)28(34-29)23-18-31-25-6-4-3-5-22(23)25/h3-8,17-20,31H,9-16H2,1-2H3,(H,32,33,34)
InChI Key:
HRYNCLKDKCPYBF-UHFFFAOYSA-N
SMILES:
COc1cc(ccc1Nc1ncc(c(n1)c1c[nH]c2c1cccc2)Cl)N1CCC(CC1)N1CCN(CC1)C
Properties
Complexity:
746  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
531.251g/mol
Formal Charge:
0
Heavy Atom Count:
38  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
532.089g/mol
Monoisotopic Mass:
531.251g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
72.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5  
Properties