2,2'-{[(3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)methyl]azanediyl}diacetic acid
Chemical Structure Depiction of
2,2'-{[(3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)methyl]azanediyl}diacetic acid
2,2'-{[(3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)methyl]azanediyl}diacetic acid
Compound characteristics
| Compound ID: | 0083-0083 |
| Compound Name: | 2,2'-{[(3,4-dihydroxy-9,10-dioxo-9,10-dihydroanthracen-2-yl)methyl]azanediyl}diacetic acid |
| Molecular Weight: | 385.33 |
| Molecular Formula: | C19 H15 N O8 |
| Smiles: | C(C(O)=O)N(CC(O)=O)Cc1cc2C(c3ccccc3C(c2c(c1O)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.6145 |
| logD: | -3.8657 |
| logSw: | -2.4232 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 117.89 |
| InChI Key: | PWIGYBONXWGOQE-UHFFFAOYSA-N |