2-(4-methoxyphenyl)-7-({4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-7-({4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(4-methoxyphenyl)-7-({4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0535 |
| Compound Name: | 2-(4-methoxyphenyl)-7-({4-[4-(propan-2-yl)benzene-1-sulfonyl]piperazin-1-yl}methyl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 539.68 |
| Molecular Formula: | C26 H29 N5 O4 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccc(cc1)OC)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9025 |
| logD: | 3.9009 |
| logSw: | -4.031 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 81.066 |
| InChI Key: | AAKAKOWJBTZNGV-UHFFFAOYSA-N |