N-benzyl-2-[(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-benzyl-2-[(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
N-benzyl-2-[(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | K615-0039 |
| Compound Name: | N-benzyl-2-[(6-{[4,6-di(piperidin-1-yl)-1,3,5-triazin-2-yl]amino}-1,3-benzothiazol-2-yl)sulfanyl]acetamide |
| Molecular Weight: | 574.77 |
| Molecular Formula: | C29 H34 N8 O S2 |
| Smiles: | C1CCN(CC1)c1nc(Nc2ccc3c(c2)sc(n3)SCC(NCc2ccccc2)=O)nc(n1)N1CCCCC1 |
| Stereo: | ACHIRAL |
| logP: | 7.7421 |
| logD: | 7.7406 |
| logSw: | -6.0483 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.192 |
| InChI Key: | PJFRQZWEVIVPAC-UHFFFAOYSA-N |