2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl 4-methylpiperazine-1-carbodithioate
Chemical Structure Depiction of
2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl 4-methylpiperazine-1-carbodithioate
2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl 4-methylpiperazine-1-carbodithioate
Compound characteristics
| Compound ID: | 5645-0137 |
| Compound Name: | 2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl 4-methylpiperazine-1-carbodithioate |
| Molecular Weight: | 450.04 |
| Molecular Formula: | C20 H20 Cl N3 O S3 |
| Smiles: | CN1CCN(CC1)C(=S)SCC(N1c2ccccc2Sc2ccc(cc12)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4444 |
| logD: | 3.6395 |
| logSw: | -4.506 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 19.9107 |
| InChI Key: | HEZMXRFVQCLQOY-UHFFFAOYSA-N |