ethyl [(2-{2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}ethyl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(2-{2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}ethyl)sulfanyl]acetate
ethyl [(2-{2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}ethyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 2958-7486 |
| Compound Name: | ethyl [(2-{2-methoxy-4-[(2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]phenoxy}ethyl)sulfanyl]acetate |
| Molecular Weight: | 408.43 |
| Molecular Formula: | C18 H20 N2 O7 S |
| Smiles: | CCOC(CSCCOc1ccc(C=C2C(NC(NC2=O)=O)=O)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2108 |
| logD: | 0.8636 |
| logSw: | -2.3342 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.937 |
| InChI Key: | OXNFLBPOLNQSIT-UHFFFAOYSA-N |