N-butyl-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-butyl-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-butyl-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0098 |
| Compound Name: | N-butyl-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 395.48 |
| Molecular Formula: | C20 H21 N5 O2 S |
| Smiles: | CCCCNc1c2ccccc2n2c(c(nn2)S(c2ccc(C)cc2)(=O)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8256 |
| logD: | 4.8256 |
| logSw: | -4.7097 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.73 |
| InChI Key: | UZTSFUSFESAXHE-UHFFFAOYSA-N |