2-(3-methoxyphenyl)-1-{2-methyl-4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(3-methoxyphenyl)-1-{2-methyl-4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
2-(3-methoxyphenyl)-1-{2-methyl-4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | V017-1288 |
| Compound Name: | 2-(3-methoxyphenyl)-1-{2-methyl-4-[3-(thiophen-2-yl)[1,2,4]triazolo[4,3-c]quinazolin-5-yl]piperazin-1-yl}ethan-1-one |
| Molecular Weight: | 498.61 |
| Molecular Formula: | C27 H26 N6 O2 S |
| Salt: | not_available |
| Smiles: | CC1CN(CCN1C(Cc1cccc(c1)OC)=O)c1nc2ccccc2c2nnc(c3cccs3)n12 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.737 |
| logD: | 4.6983 |
| logSw: | -4.8451 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 56.702 |
| InChI Key: | SINXYXGINURPOA-SFHVURJKSA-N |