3-{[(4-nitrophenyl)methyl]sulfanyl}-1,2,4-thiadiazol-5-amine
Chemical Structure Depiction of
3-{[(4-nitrophenyl)methyl]sulfanyl}-1,2,4-thiadiazol-5-amine
3-{[(4-nitrophenyl)methyl]sulfanyl}-1,2,4-thiadiazol-5-amine
Compound characteristics
| Compound ID: | 8019-8772 |
| Compound Name: | 3-{[(4-nitrophenyl)methyl]sulfanyl}-1,2,4-thiadiazol-5-amine |
| Molecular Weight: | 268.31 |
| Molecular Formula: | C9 H8 N4 O2 S2 |
| Smiles: | C(c1ccc(cc1)[N+]([O-])=O)Sc1nc(N)sn1 |
| Stereo: | ACHIRAL |
| logP: | 2.2198 |
| logD: | 2.2198 |
| logSw: | -2.4884 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.687 |
| InChI Key: | FYFDEGXDITYCHD-UHFFFAOYSA-N |