N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea
Compound characteristics
| Compound ID: | G373-3502 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-N'-{2-[5-(piperidine-1-carbonyl)-1H-benzotriazol-1-yl]ethyl}urea |
| Molecular Weight: | 450.5 |
| Molecular Formula: | C23 H26 N6 O4 |
| Smiles: | C1CCN(CC1)C(c1ccc2c(c1)nnn2CCNC(Nc1ccc2c(c1)OCCO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.1319 |
| logD: | 1.1319 |
| logSw: | -2.0736 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.853 |
| InChI Key: | HIRWQVXLYLCRJZ-UHFFFAOYSA-N |