| Formula |
C22H27N5O4 |
| IUPAC Name |
ethyl 4-[5-[(2,4-diaminoquinazolin-6-yl)methylamino]-2-methoxy-phenoxy]butanoate |
| Molecular Mass |
425.481 g·mol−1 |
| Heat of Formation |
-428.8 ± 16.7 kJ·mol−1 |
| Dipole Moment |
3.17 ± 1.08 D |
| Volume |
501.77 Å 3 |
| Surface Area |
469.64 Å 2 |
| HOMO Energy |
-7.80 ± 0.55 eV |
| LUMO Energy |
2.35 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 4-[5-[(2,4-diamino-6-quinazolinyl)methylamino]-2-methoxyphenoxy]butanoic acid ethyl ester
- 4-[5-[(2,4-diaminoquinazolin-6-yl)methylamino]-2-methoxy-phenoxy]butyric acid ethyl ester
- ethyl 4-[5-[(2,4-diaminoquinazolin-6-yl)methylamino]-2-methoxyphenoxy]butanoate
|
| InChIKey |
YUHXPHNBJFUHSN-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
Get JSON data
Get MOL2 data
Get SVG Image
|
| Elements |
H
C
O
N
|
| |
|
