4-[4-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-4-oxobutyl]-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Chemical Structure Depiction of
4-[4-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-4-oxobutyl]-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
4-[4-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-4-oxobutyl]-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
Compound characteristics
| Compound ID: | S517-1292 |
| Compound Name: | 4-[4-(4-{[4-(cyclopropylmethyl)-4H-1,2,4-triazol-3-yl]methyl}piperidin-1-yl)-4-oxobutyl]-2-phenyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one |
| Molecular Weight: | 514.63 |
| Molecular Formula: | C29 H34 N6 O3 |
| Smiles: | C(CC(N1CCC(CC1)Cc1nncn1CC1CC1)=O)CN1C(C(c2ccccc2)Oc2cccnc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6645 |
| logD: | 2.6642 |
| logSw: | -2.8855 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 75.038 |
| InChI Key: | BWZWVKMBYNZOJE-MHZLTWQESA-N |