2-({[2-(adamantan-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5,7-dichloro-6-methyl-1,3-benzoxazole
Chemical Structure Depiction of
2-({[2-(adamantan-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5,7-dichloro-6-methyl-1,3-benzoxazole
2-({[2-(adamantan-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5,7-dichloro-6-methyl-1,3-benzoxazole
Compound characteristics
| Compound ID: | 8017-5564 |
| Compound Name: | 2-({[2-(adamantan-1-yl)-1,3-thiazol-4-yl]methyl}sulfanyl)-5,7-dichloro-6-methyl-1,3-benzoxazole |
| Molecular Weight: | 465.46 |
| Molecular Formula: | C22 H22 Cl2 N2 O S2 |
| Smiles: | Cc1c(cc2c(c1[Cl])oc(n2)SCc1csc(C23CC4CC(CC(C4)C3)C2)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 8.5457 |
| logD: | 8.5457 |
| logSw: | -7.2421 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 27.1258 |
| InChI Key: | HSGAMCCTWVEKQH-UHFFFAOYSA-N |