2-(3,5-dibromo-2-hydroxyphenyl)-2-oxoethyl morpholine-4-carbodithioate
Chemical Structure Depiction of
2-(3,5-dibromo-2-hydroxyphenyl)-2-oxoethyl morpholine-4-carbodithioate
2-(3,5-dibromo-2-hydroxyphenyl)-2-oxoethyl morpholine-4-carbodithioate
Compound characteristics
| Compound ID: | 8005-9210 |
| Compound Name: | 2-(3,5-dibromo-2-hydroxyphenyl)-2-oxoethyl morpholine-4-carbodithioate |
| Molecular Weight: | 455.18 |
| Molecular Formula: | C13 H13 Br2 N O3 S2 |
| Smiles: | C1COCCN1C(=S)SCC(c1cc(cc(c1O)[Br])[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.7787 |
| logD: | 3.4438 |
| logSw: | -3.8365 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.693 |
| InChI Key: | JVFWXNWQJFZJRD-UHFFFAOYSA-N |