3-methyl-N-[2-(8-oxo-7,8-dihydro-9H-purin-9-yl)ethyl]thiophene-2-carboxamide
Chemical Structure Depiction of
3-methyl-N-[2-(8-oxo-7,8-dihydro-9H-purin-9-yl)ethyl]thiophene-2-carboxamide
3-methyl-N-[2-(8-oxo-7,8-dihydro-9H-purin-9-yl)ethyl]thiophene-2-carboxamide
Compound characteristics
| Compound ID: | P814-6499 |
| Compound Name: | 3-methyl-N-[2-(8-oxo-7,8-dihydro-9H-purin-9-yl)ethyl]thiophene-2-carboxamide |
| Molecular Weight: | 303.34 |
| Molecular Formula: | C13 H13 N5 O2 S |
| Smiles: | Cc1ccsc1C(NCCN1C(Nc2cncnc12)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2662 |
| logD: | 1.266 |
| logSw: | -1.8883 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 74.148 |
| InChI Key: | SXYULPCOEHXPST-UHFFFAOYSA-N |