ethyl 3-amino-7-nitroisoquinoline-4-carboxylate
Chemical Structure Depiction of
ethyl 3-amino-7-nitroisoquinoline-4-carboxylate
ethyl 3-amino-7-nitroisoquinoline-4-carboxylate
Compound characteristics
| Compound ID: | 8019-3489 |
| Compound Name: | ethyl 3-amino-7-nitroisoquinoline-4-carboxylate |
| Molecular Weight: | 261.23 |
| Molecular Formula: | C12 H11 N3 O4 |
| Smiles: | CCOC(c1c2ccc(cc2cnc1N)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1746 |
| logD: | 2.1746 |
| logSw: | -2.8469 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.936 |
| InChI Key: | RTPWEJKPYMSLFA-UHFFFAOYSA-N |