({2-[(9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-2-oxoethyl}sulfanyl)acetic acid
Chemical Structure Depiction of
({2-[(9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-2-oxoethyl}sulfanyl)acetic acid
({2-[(9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-2-oxoethyl}sulfanyl)acetic acid
Compound characteristics
| Compound ID: | 8019-9357 |
| Compound Name: | ({2-[(9,10-dioxo-9,10-dihydroanthracen-1-yl)amino]-2-oxoethyl}sulfanyl)acetic acid |
| Molecular Weight: | 355.37 |
| Molecular Formula: | C18 H13 N O5 S |
| Smiles: | C(C(O)=O)SCC(Nc1cccc2C(c3ccccc3C(c12)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6086 |
| logD: | -0.7599 |
| logSw: | -3.3723 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.016 |
| InChI Key: | MIJQSSBPZJVMFP-UHFFFAOYSA-N |