7-({[4-propyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[4-propyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
7-({[4-propyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | Y205-7293 |
| Compound Name: | 7-({[4-propyl-5-(4,5,6,7-tetrahydro-1-benzothiophen-3-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}methyl)-5H-[1,3]thiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 443.61 |
| Molecular Formula: | C20 H21 N5 O S3 |
| Smiles: | CCCn1c(c2csc3CCCCc23)nnc1SCC1=CC(N2C=CSC2=N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7881 |
| logD: | 3.788 |
| logSw: | -3.9227 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.113 |
| InChI Key: | AJDJYTWBPURHKN-UHFFFAOYSA-N |