3-(4-methoxyphenyl)-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
3-(4-methoxyphenyl)-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
3-(4-methoxyphenyl)-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: | S352-0117 |
| Compound Name: | 3-(4-methoxyphenyl)-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: | 473.53 |
| Molecular Formula: | C26 H27 N5 O4 |
| Smiles: | COc1ccc(/C=C/C(N2CCN(CC2)C(c2c3COC(Cn3nn2)c2ccccc2)=O)=O)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0017 |
| logD: | 2.0017 |
| logSw: | -2.1673 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.881 |
| InChI Key: | RAHARXMYSSPEKQ-HSZRJFAPSA-N |