1-(azepan-1-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}ethan-1-one
1-(azepan-1-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}ethan-1-one
Compound characteristics
| Compound ID: | 5867-4116 |
| Compound Name: | 1-(azepan-1-yl)-2-{[5-(4-chlorophenyl)[1,3]thiazolo[2,3-c][1,2,4]triazol-3-yl]sulfanyl}ethan-1-one |
| Molecular Weight: | 406.95 |
| Molecular Formula: | C18 H19 Cl N4 O S2 |
| Smiles: | C1CCCN(CC1)C(CSc1nnc2n1c(cs2)c1ccc(cc1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.4706 |
| logD: | 4.4706 |
| logSw: | -4.6578 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 38.509 |
| InChI Key: | JCCDEOKBFGQUKU-UHFFFAOYSA-N |