Formula |
C11H10N4OS |
IUPAC Name |
2-amino-7-(3-thienylmethyl)-5,6-dihydro-1h-pyrrolo[3,2-d]pyrimidine-2,3,4a,6,7,7a-hexaid-4-one |
Molecular Mass |
246.288 g·mol−1 |
Heat of Formation |
148.0 ± 16.7 kJ·mol−1 |
Dipole Moment |
6.18 ± 1.08 D |
Volume |
274.31 Å 3 |
Surface Area |
246.32 Å 2 |
HOMO Energy |
-8.83 ± 0.55 eV |
LUMO Energy |
-0.93 ± eV |
Point Group Symmetry |
C1
|
Synonyms
|
- 2-amino-1,5-dihydro-7-(3-thienylmethyl)-4h-pyrrolo(3,2-d)pyrimidin-4-one
- 2-amino-7-(3-thienylmethyl)-1,5-dihydropyrrolo[2,3-e]pyrimidin-4-one
- 2-amino-7-(thiophen-3-ylmethyl)-1,5-dihydropyrrolo[2,3-e]pyrimidin-4-one
- 4h-pyrrolo(3,2-d)pyrimidin-4-one, 2-amino-1,5-dihydro-7-(3-thienylmethyl)-
- 9-deaza-9-(3-thienylmethyl)guanine
- ci 1000
- ci 1000 (immunosuppressant)
- pd 141955
|
CAS Number(s) |
|
InChIKey |
QDPMHXUWMPNTEQ-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
|
|
|