Formula |
C27H36N6O3S |
IUPAC Name |
n-tert-butyl-3-[[5-methyl-2-[4-(2-pyrrolidin-1-ylethoxy)anilino]pyrimidin-4-yl]amino]benzenesulfonamide |
Molecular Mass |
524.678 g·mol−1 |
Heat of Formation |
-290.2 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.96 ± 1.08 D |
Volume |
630.07 Å 3 |
Surface Area |
466.15 Å 2 |
HOMO Energy |
-8.28 ± 0.55 eV |
LUMO Energy |
2.35 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- n-tert-butyl-3-[[5-methyl-2-[[4-(2-1-pyrrolidinylethoxy)phenyl]amino]-4-pyrimidinyl]amino]benzenesulfonamide
- n-tert-butyl-3-[[5-methyl-2-[[4-(2-pyrrolidin-1-ylethoxy)phenyl]amino]pyrimidin-4-yl]amino]benzenesulfonamide
|
InChIKey |
JOOXLOJCABQBSG-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
H
S
C
O
N
|
|
|