ethyl 4-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}benzoate
Chemical Structure Depiction of
ethyl 4-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}benzoate
ethyl 4-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}benzoate
Compound characteristics
| Compound ID: | C718-0545 |
| Compound Name: | ethyl 4-{[3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-yl]amino}benzoate |
| Molecular Weight: | 487.54 |
| Molecular Formula: | C25 H21 N5 O4 S |
| Smiles: | CCOC(c1ccc(cc1)Nc1c2ccccc2n2c(c(nn2)S(c2ccc(C)cc2)(=O)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6217 |
| logD: | 5.6217 |
| logSw: | -5.681 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 92.049 |
| InChI Key: | NSZIIKCBDJMCFJ-UHFFFAOYSA-N |