{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
Chemical Structure Depiction of
{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
{4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone
Compound characteristics
| Compound ID: | S352-0350 |
| Compound Name: | {4-[6-(4-chlorophenyl)-6,7-dihydro-4H-[1,2,3]triazolo[5,1-c][1,4]oxazine-3-carbonyl]piperazin-1-yl}(thiophen-2-yl)methanone |
| Molecular Weight: | 457.94 |
| Molecular Formula: | C21 H20 Cl N5 O3 S |
| Smiles: | C1CN(CCN1C(c1c2COC(Cn2nn1)c1ccc(cc1)[Cl])=O)C(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.0495 |
| logD: | 2.0495 |
| logSw: | -2.7997 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 68.882 |
| InChI Key: | ADYARZKARZTILR-KRWDZBQOSA-N |