N-phenyl-2-(2-sulfanylidene-2H,5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-6(7H)-ylidene)hydrazine-1-carbothioamide
Chemical Structure Depiction of
N-phenyl-2-(2-sulfanylidene-2H,5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-6(7H)-ylidene)hydrazine-1-carbothioamide
N-phenyl-2-(2-sulfanylidene-2H,5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-6(7H)-ylidene)hydrazine-1-carbothioamide
Compound characteristics
| Compound ID: | 8009-7699 |
| Compound Name: | N-phenyl-2-(2-sulfanylidene-2H,5H-[1,3]dithiolo[4,5-b][1,4]dithiepin-6(7H)-ylidene)hydrazine-1-carbothioamide |
| Molecular Weight: | 401.63 |
| Molecular Formula: | C13 H11 N3 S6 |
| Smiles: | C1C(CSC2=C(S1)SC(=S)S2)=NNC(Nc1ccccc1)=S |
| Stereo: | ACHIRAL |
| logP: | 5.1255 |
| logD: | 5.1255 |
| logSw: | -5.4291 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 32.132 |
| InChI Key: | ZVGYLFJGUNVASP-UHFFFAOYSA-N |