Gsk1292263

C₂₃H₂₈N₄O₄SCAS 1032823-75-8456.56 g/mol

Open in Covalent MOL file

Ether Sulfone Tertiary amine

Properties

Molecular formula: C₂₃H₂₈N₄O₄S
Molar mass: 456.56 g/mol
Exact mass: 456.1831 Da
logP: 3.95Crippen estimate
Polar surface area: 98.4 Å²
H-bond donors / acceptors: 0 / 8
Rotatable bonds: 7

Identifiers

CAS number

1032823-75-8

SMILES

CC(C)C1=NOC(=N1)N2CCC(CC2)COC3=CN=C(C=C3)C4=CC=C(C=C4)S(=O)(=O)C

InChIKey

AYJRTVVIBJSSKN-UHFFFAOYSA-N

InChI

InChI=1S/C23H28N4O4S/c1-16(2)22-25-23(31-26-22)27-12-10-17(11-13-27)15-30-19-6-9-21(24-14-19)18-4-7-20(8-5-18)32(3,28)29/h4-9,14,16-17H,10-13,15H2,1-3H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Gsk1292263

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Elsewhere

PubChem CAS Common Chemistry NIST WebBook