5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Chemical Structure Depiction of
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline
Compound characteristics
| Compound ID: | E694-0018 |
| Compound Name: | 5-(1,4-dioxa-8-azaspiro[4.5]decan-8-yl)-3-(4-methylbenzene-1-sulfonyl)[1,2,3]triazolo[1,5-a]quinazoline |
| Molecular Weight: | 465.53 |
| Molecular Formula: | C23 H23 N5 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1c2nc(c3ccccc3n2nn1)N1CCC2(CC1)OCCO2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6943 |
| logD: | 3.6943 |
| logSw: | -3.856 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 79.565 |
| InChI Key: | UPPRTXMPOHFJCM-UHFFFAOYSA-N |