| Formula |
C16H16N4OS |
| IUPAC Name |
2-amino-6-(aminomethyl)-8-(phenylsulfanylmethyl)-1h-quinazolin-4-one |
| Molecular Mass |
312.389 g·mol−1 |
| Heat of Formation |
96.4 ± 16.7 kJ·mol−1 |
| Dipole Moment |
4.39 ± 1.08 D |
| Volume |
361.54 Å 3 |
| Surface Area |
331.66 Å 2 |
| HOMO Energy |
-8.26 ± 0.55 eV |
| LUMO Energy |
2.26 ± eV |
| Point Group Symmetry |
C1
|
| Synonyms
|
- 2-amino-6-(aminomethyl)-8-(phenylsulfanylmethyl)-1h-quinazolin-4-one
- 2-amino-6-(aminomethyl)-8-[(phenylthio)methyl]-1h-quinazolin-4-one
- 2-amino-6-aminomethyl-8-phenylsulfanylmethyl-3h-quinazolin-4-one
|
| InChIKey |
CBFXRTSHUMEYKQ-UHFFFAOYSA-N |
| QR Code |
Generate QR Code |
| Links |
PubChem
ChemSpider
|
| DOI |
|
| Downloads |
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|
| Elements |
H
C
S
O
N
|
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