6,7-diamino-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
Chemical Structure Depiction of
6,7-diamino-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
6,7-diamino-1H,3H-naphtho[1,8-cd]pyran-1,3-dione
Compound characteristics
| Compound ID: | 0109-0214 |
| Compound Name: | 6,7-diamino-1H,3H-naphtho[1,8-cd]pyran-1,3-dione |
| Molecular Weight: | 228.2 |
| Molecular Formula: | C12 H8 N2 O3 |
| Smiles: | c1cc(c2c(ccc3C(=O)OC(c1c23)=O)N)N |
| Stereo: | ACHIRAL |
| logP: | 1.1704 |
| logD: | 1.1704 |
| logSw: | -2.0514 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 74.917 |
| InChI Key: | XCUAGUWTAIIJQR-UHFFFAOYSA-N |