2-(3-fluorophenyl)-7-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(3-fluorophenyl)-7-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(3-fluorophenyl)-7-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | F570-0350 |
| Compound Name: | 2-(3-fluorophenyl)-7-{[4-(thiophene-2-sulfonyl)piperazin-1-yl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C20 H18 F N5 O3 S3 |
| Smiles: | C1CN(CCN1CC1=CC(N2C(=N1)SC(c1cccc(c1)F)=N2)=O)S(c1cccs1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2853 |
| logD: | 2.283 |
| logSw: | -2.7294 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 74.54 |
| InChI Key: | HEFDYLXPACVUQN-UHFFFAOYSA-N |