2-methyl-3-phenyl-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one
Chemical Structure Depiction of
2-methyl-3-phenyl-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one
2-methyl-3-phenyl-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one
Compound characteristics
| Compound ID: | S352-0074 |
| Compound Name: | 2-methyl-3-phenyl-1-[4-(6-phenyl-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl)piperazin-1-yl]prop-2-en-1-one |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C26 H27 N5 O3 |
| Smiles: | C/C(=C\c1ccccc1)C(N1CCN(CC1)C(c1c2COC(Cn2nn1)c1ccccc1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5017 |
| logD: | 2.5017 |
| logSw: | -2.4094 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 67.864 |
| InChI Key: | UUMCABWIISZBOD-HSZRJFAPSA-N |