6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-(3,4-dimethoxyphenyl)-1,2,4-triazin-5(2H)-one
Chemical Structure Depiction of
6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-(3,4-dimethoxyphenyl)-1,2,4-triazin-5(2H)-one
6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-(3,4-dimethoxyphenyl)-1,2,4-triazin-5(2H)-one
Compound characteristics
| Compound ID: | V022-5180 |
| Compound Name: | 6-[3-(4-benzylpiperazin-1-yl)-3-oxopropyl]-3-(3,4-dimethoxyphenyl)-1,2,4-triazin-5(2H)-one |
| Molecular Weight: | 463.54 |
| Molecular Formula: | C25 H29 N5 O4 |
| Smiles: | COc1ccc(cc1OC)C1NN=C(CCC(N2CCN(CC2)Cc2ccccc2)=O)C(N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3726 |
| logD: | 1.3726 |
| logSw: | -2.131 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.502 |
| InChI Key: | WVLMIEXZEMLUDL-UHFFFAOYSA-N |