N-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Chemical Structure Depiction of
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
N-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine
Compound characteristics
| Compound ID: | E694-0046 |
| Compound Name: | N-[2-(cyclohex-1-en-1-yl)ethyl]-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazolin-5-amine |
| Molecular Weight: | 447.56 |
| Molecular Formula: | C24 H25 N5 O2 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)NCCC1CCCCC=1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3171 |
| logD: | 5.3171 |
| logSw: | -5.4937 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.651 |
| InChI Key: | MTTIKNVUHVRLOH-UHFFFAOYSA-N |