Formula |
C19H15F3N6OS2 |
IUPAC Name |
1-[5-[2-(thieno[3,2-d]pyrimidin-4-ylamino)ethyl]thiazol-2-yl]-3-[3-(trifluoromethyl)phenyl]urea |
Molecular Mass |
464.487 g·mol−1 |
Heat of Formation |
-328.4 ± 16.7 kJ·mol−1 |
Dipole Moment |
4.55 ± 1.08 D |
Volume |
487.59 Å 3 |
Surface Area |
444.36 Å 2 |
HOMO Energy |
-8.58 ± 0.55 eV |
LUMO Energy |
-1.24 ± eV |
Point Group Symmetry |
C1
|
InChIKey |
JJHXPDTVQKWKHA-UHFFFAOYSA-N |
QR Code |
Generate QR Code |
Links |
PubChem
ChemSpider
|
DOI |
|
Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
Elements |
C
F
H
O
N
S
|
|
|