2-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]-4-(2-methylpropyl)pyrido[3,4-b]pyrazin-3(4H)-one
Chemical Structure Depiction of
2-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]-4-(2-methylpropyl)pyrido[3,4-b]pyrazin-3(4H)-one
2-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]-4-(2-methylpropyl)pyrido[3,4-b]pyrazin-3(4H)-one
Compound characteristics
| Compound ID: | T841-1643 |
| Compound Name: | 2-[4-(3-methylbenzene-1-sulfonyl)piperazin-1-yl]-4-(2-methylpropyl)pyrido[3,4-b]pyrazin-3(4H)-one |
| Molecular Weight: | 441.55 |
| Molecular Formula: | C22 H27 N5 O3 S |
| Smiles: | CC(C)CN1C(C(=Nc2ccncc12)N1CCN(CC1)S(c1cccc(C)c1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9519 |
| logD: | 2.9519 |
| logSw: | -3.1814 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 67.528 |
| InChI Key: | HXMHGQCULDFJFI-UHFFFAOYSA-N |