5-({[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Chemical Structure Depiction of
5-({[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
5-({[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one
Compound characteristics
| Compound ID: | 8018-3664 |
| Compound Name: | 5-({[(2-cyclohexyl-1,3-thiazol-4-yl)methyl]sulfanyl}methyl)-2,4-dihydro-3H-1,2,4-triazol-3-one |
| Molecular Weight: | 310.44 |
| Molecular Formula: | C13 H18 N4 O S2 |
| Smiles: | C1CCC(CC1)c1nc(CSCC2NC(NN=2)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 3.4339 |
| logD: | 3.0532 |
| logSw: | -3.4951 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.847 |
| InChI Key: | UMECILAYXONBPX-UHFFFAOYSA-N |