1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-5-(3-methyl-1H-indazol-1-yl)pentane-1,5-dione
Chemical Structure Depiction of
1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-5-(3-methyl-1H-indazol-1-yl)pentane-1,5-dione
1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-5-(3-methyl-1H-indazol-1-yl)pentane-1,5-dione
Compound characteristics
| Compound ID: | S517-0359 |
| Compound Name: | 1-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-5-(3-methyl-1H-indazol-1-yl)pentane-1,5-dione |
| Molecular Weight: | 448.57 |
| Molecular Formula: | C25 H32 N6 O2 |
| Smiles: | Cc1c2ccccc2n(C(CCCC(N2CCC(CC2)Cc2nncn2CC2CC2)=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9757 |
| logD: | 1.9754 |
| logSw: | -2.1989 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.804 |
| InChI Key: | KRACPBNQSQSUIT-UHFFFAOYSA-N |