2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy}acetamide
Chemical Structure Depiction of
2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy}acetamide
2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy}acetamide
Compound characteristics
| Compound ID: | 4058-0060 |
| Compound Name: | 2-{4-[(4,6-dioxo-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]phenoxy}acetamide |
| Molecular Weight: | 305.31 |
| Molecular Formula: | C13 H11 N3 O4 S |
| Smiles: | C(C(N)=O)Oc1ccc(C=C2C(NC(NC2=O)=S)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 0.4372 |
| logD: | 0.0116 |
| logSw: | -2.0267 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 90.513 |
| InChI Key: | LERBSTKHDLUSPN-UHFFFAOYSA-N |