2-(2-fluorophenyl)-7-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(2-fluorophenyl)-7-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(2-fluorophenyl)-7-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0304 |
| Compound Name: | 2-(2-fluorophenyl)-7-{[4-(5,6,7,8-tetrahydronaphthalene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 539.65 |
| Molecular Formula: | C26 H26 F N5 O3 S2 |
| Smiles: | C1CCc2cc(ccc2C1)S(N1CCN(CC1)CC1=CC(N2C(=N1)SC(c1ccccc1F)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8447 |
| logD: | 3.8431 |
| logSw: | -4.0606 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.443 |
| InChI Key: | FHPJYJQHRSASTD-UHFFFAOYSA-N |