N-(2-phenylpropyl)-3-(2,4,6-trimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-(2-phenylpropyl)-3-(2,4,6-trimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-(2-phenylpropyl)-3-(2,4,6-trimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0480 |
| Compound Name: | N-(2-phenylpropyl)-3-(2,4,6-trimethylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 485.61 |
| Molecular Formula: | C27 H27 N5 O2 S |
| Smiles: | CC(CNc1c2ccccc2n2c(c(nn2)S(c2c(C)cc(C)cc2C)(=O)=O)n1)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.5293 |
| logD: | 6.5293 |
| logSw: | -5.9697 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.617 |
| InChI Key: | XFYFDHDNDKMEAG-FQEVSTJZSA-N |