4,4'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dibutanoic acid
Chemical Structure Depiction of
4,4'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dibutanoic acid
4,4'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dibutanoic acid
Compound characteristics
| Compound ID: | 8017-7687 |
| Compound Name: | 4,4'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dibutanoic acid |
| Molecular Weight: | 396.4 |
| Molecular Formula: | C16 H24 N6 O6 |
| Smiles: | C(CC(O)=O)CN1CN2C3C4N(CN(CCCC(O)=O)CN4C(N3C1)=O)C2=O |
| Stereo: | ACHIRAL |
| logP: | -1.0622 |
| logD: | -1.0622 |
| logSw: | -0.0178 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.915 |
| InChI Key: | VMPILIVEAICKGG-UHFFFAOYSA-N |