7-({[5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-({[5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | Y205-5795 |
| Compound Name: | 7-({[5-(2-cyclohexylethyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 389.54 |
| Molecular Formula: | C18 H23 N5 O S2 |
| Smiles: | Cn1c(CCC2CCCCC2)nnc1SCC1=CC(N2C=CSC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7023 |
| logD: | 2.7022 |
| logSw: | -2.8111 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 52.174 |
| InChI Key: | ITJLJAGISHNNSQ-UHFFFAOYSA-N |