3-(3,4-dimethylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
3-(3,4-dimethylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
3-(3,4-dimethylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | C718-0167 |
| Compound Name: | 3-(3,4-dimethylbenzene-1-sulfonyl)-N-[(4-methylphenyl)methyl][1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 457.55 |
| Molecular Formula: | C25 H23 N5 O2 S |
| Smiles: | Cc1ccc(CNc2c3ccccc3n3c(c(nn3)S(c3ccc(C)c(C)c3)(=O)=O)n2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 5.4791 |
| logD: | 5.4791 |
| logSw: | -5.7182 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.617 |
| InChI Key: | TTZMGWBUJBIXLK-UHFFFAOYSA-N |