3,3'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dipropanoic acid
Chemical Structure Depiction of
3,3'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dipropanoic acid
3,3'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dipropanoic acid
Compound characteristics
| Compound ID: | 8017-7330 |
| Compound Name: | 3,3'-(4,8-dioxodihydro-1H,4H,5H,8H-2,3a,4a,6,7a,8a-hexaazacyclopenta[def]fluorene-2,6(3H,7H)-diyl)dipropanoic acid |
| Molecular Weight: | 368.35 |
| Molecular Formula: | C14 H20 N6 O6 |
| Smiles: | C(CN1CN2C3C4N(CN(CCC(O)=O)CN4C(N3C1)=O)C2=O)C(O)=O |
| Stereo: | ACHIRAL |
| logP: | -1.7928 |
| logD: | -4.6517 |
| logSw: | -0.1081 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 106.915 |
| InChI Key: | YNWDYTBNVAAEFF-UHFFFAOYSA-N |