5-[4-({[(4-fluorophenyl)methyl]sulfanyl}acetyl)piperazin-1-yl]-3,6-dimethyl-1-phenylpyrimidine-2,4(1H,3H)-dione
Chemical Structure Depiction of
5-[4-({[(4-fluorophenyl)methyl]sulfanyl}acetyl)piperazin-1-yl]-3,6-dimethyl-1-phenylpyrimidine-2,4(1H,3H)-dione
5-[4-({[(4-fluorophenyl)methyl]sulfanyl}acetyl)piperazin-1-yl]-3,6-dimethyl-1-phenylpyrimidine-2,4(1H,3H)-dione
Compound characteristics
| Compound ID: | F667-0568 |
| Compound Name: | 5-[4-({[(4-fluorophenyl)methyl]sulfanyl}acetyl)piperazin-1-yl]-3,6-dimethyl-1-phenylpyrimidine-2,4(1H,3H)-dione |
| Molecular Weight: | 482.58 |
| Molecular Formula: | C25 H27 F N4 O3 S |
| Smiles: | CC1=C(C(N(C)C(N1c1ccccc1)=O)=O)N1CCN(CC1)C(CSCc1ccc(cc1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9456 |
| logD: | 2.9447 |
| logSw: | -3.0801 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.493 |
| InChI Key: | JCGHHSTYRHBBMG-UHFFFAOYSA-N |