5-{[(2-chloro-6-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine
Chemical Structure Depiction of
5-{[(2-chloro-6-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine
5-{[(2-chloro-6-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine
Compound characteristics
| Compound ID: | 3448-1093 |
| Compound Name: | 5-{[(2-chloro-6-nitrophenyl)methyl]sulfanyl}-1,3,4-thiadiazol-2-amine |
| Molecular Weight: | 302.76 |
| Molecular Formula: | C9 H7 Cl N4 O2 S2 |
| Smiles: | C(c1c(cccc1[Cl])[N+]([O-])=O)Sc1nnc(N)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8091 |
| logD: | 2.8091 |
| logSw: | -3.36 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.71 |
| InChI Key: | CKPVSUGMOJHCTK-UHFFFAOYSA-N |