6-(3-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-3-oxopropyl)-3-(3-methoxy-4-propoxyphenyl)-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-(3-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-3-oxopropyl)-3-(3-methoxy-4-propoxyphenyl)-1,2,4-triazin-5(2H)-one
6-(3-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-3-oxopropyl)-3-(3-methoxy-4-propoxyphenyl)-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | P207-9157 |
| Compound Name: | 6-(3-{4-[(4-fluorophenyl)methyl]piperazin-1-yl}-3-oxopropyl)-3-(3-methoxy-4-propoxyphenyl)-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 509.58 |
| Molecular Formula: | C27 H32 F N5 O4 |
| Smiles: | CCCOc1ccc(cc1OC)C1NN=C(CCC(N2CCN(CC2)Cc2ccc(cc2)F)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4238 |
| logD: | 2.4238 |
| logSw: | -2.8494 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.376 |
| InChI Key: | HTRUPSLVSMDXSJ-UHFFFAOYSA-N |