6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4(3H)-one
Chemical Structure Depiction of
6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4(3H)-one
6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4(3H)-one
Compound characteristics
| Compound ID: | V021-6412 |
| Compound Name: | 6-[(4-benzylpiperazin-1-yl)methyl]-2-[4-(2,4,6-trimethylbenzene-1-sulfonyl)piperazin-1-yl]pyrimidin-4(3H)-one |
| Molecular Weight: | 550.72 |
| Molecular Formula: | C29 H38 N6 O3 S |
| Salt: | not_available |
| Smiles: | Cc1cc(C)c(c(C)c1)S(N1CCN(CC1)C1NC(C=C(CN2CCN(CC2)Cc2ccccc2)N=1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1702 |
| logD: | 1.3828 |
| logSw: | -3.3024 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.155 |
| InChI Key: | IILKNAMURPBFPI-UHFFFAOYSA-N |