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191588-95-1 | 1H-INDOLE-5-METHANESULFONAMIDE, 3-[3-[4-(5-METHOXY-4-PYRIMIDINYL)-1-PIPERAZINYL]PROPYL]-N-METHYL-2-(TRIMETHYLSILYL)-
CAS No: 191588-95-1 Catalog No: AG002FC8 MDL No:
Product Description
Catalog Number:
AG002FC8
Chemical Name:
1H-INDOLE-5-METHANESULFONAMIDE, 3-[3-[4-(5-METHOXY-4-PYRIMIDINYL)-1-PIPERAZINYL]PROPYL]-N-METHYL-2-(TRIMETHYLSILYL)-
CAS Number:
191588-95-1
Molecular Formula:
C25H38N6O3SSi
Molecular Weight:
530.7581
IUPAC Name:
1-[3-[3-[4-(5-methoxypyrimidin-4-yl)piperazin-1-yl]propyl]-2-trimethylsilyl-1H-indol-5-yl]-N-methylmethanesulfonamide
InChI:
InChI=1S/C25H38N6O3SSi/c1-26-35(32,33)17-19-8-9-22-21(15-19)20(25(29-22)36(3,4)5)7-6-10-30-11-13-31(14-12-30)24-23(34-2)16-27-18-28-24/h8-9,15-16,18,26,29H,6-7,10-14,17H2,1-5H3
InChI Key:
JQBXSYLZFVGVFR-UHFFFAOYSA-N
SMILES:
COc1cncnc1N1CCN(CC1)CCCc1c2cc(ccc2[nH]c1[Si](C)(C)C)CS(=O)(=O)NC
Properties
Complexity:
799
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
530.25g/mol
Formal Charge:
0
Heavy Atom Count:
36
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
530.763g/mol
Monoisotopic Mass:
530.25g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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