ethyl [(2-{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
Chemical Structure Depiction of
ethyl [(2-{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
ethyl [(2-{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate
Compound characteristics
| Compound ID: | 2958-7519 |
| Compound Name: | ethyl [(2-{4-[(1,3-dimethyl-2,4,6-trioxo-1,3-diazinan-5-ylidene)methyl]-2-methoxyphenoxy}ethyl)sulfanyl]acetate |
| Molecular Weight: | 436.48 |
| Molecular Formula: | C20 H24 N2 O7 S |
| Smiles: | CCOC(CSCCOc1ccc(C=C2C(N(C)C(N(C)C2=O)=O)=O)cc1OC)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0683 |
| logD: | 2.0683 |
| logSw: | -2.7217 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 80.419 |
| InChI Key: | QFHWUXKSOCBVBH-UHFFFAOYSA-N |