1-{[4-amino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]methyl}-4-(2-chlorophenyl)-1,4-dihydro-5H-tetrazol-5-one
Chemical Structure Depiction of
1-{[4-amino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]methyl}-4-(2-chlorophenyl)-1,4-dihydro-5H-tetrazol-5-one
1-{[4-amino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]methyl}-4-(2-chlorophenyl)-1,4-dihydro-5H-tetrazol-5-one
Compound characteristics
| Compound ID: | 8019-8781 |
| Compound Name: | 1-{[4-amino-6-(piperidin-1-yl)-1,3,5-triazin-2-yl]methyl}-4-(2-chlorophenyl)-1,4-dihydro-5H-tetrazol-5-one |
| Molecular Weight: | 387.83 |
| Molecular Formula: | C16 H18 Cl N9 O |
| Smiles: | C1CCN(CC1)c1nc(CN2C(N(c3ccccc3[Cl])N=N2)=O)nc(N)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.0902 |
| logD: | 3.0902 |
| logSw: | -3.3174 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 98.445 |
| InChI Key: | LNALTLLAQLFAMY-UHFFFAOYSA-N |