2,2'-{[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]azanediyl}diacetic acid
Chemical Structure Depiction of
2,2'-{[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]azanediyl}diacetic acid
2,2'-{[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]azanediyl}diacetic acid
Compound characteristics
| Compound ID: | Y041-2116 |
| Compound Name: | 2,2'-{[3-(3,5-dimethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propanoyl]azanediyl}diacetic acid |
| Molecular Weight: | 401.37 |
| Molecular Formula: | C20 H19 N O8 |
| Smiles: | CC1=C(CCC(N(CC(O)=O)CC(O)=O)=O)C(=O)Oc2cc3c(cc12)c(C)co3 |
| Stereo: | ACHIRAL |
| logP: | -0.4696 |
| logD: | -4.3979 |
| logSw: | -1.4009 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.443 |
| InChI Key: | FZTWZLSYBQQRDP-UHFFFAOYSA-N |