N-[2-(4-methoxyphenyl)ethyl]-N'-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-6-yl)urea
Chemical Structure Depiction of
N-[2-(4-methoxyphenyl)ethyl]-N'-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-6-yl)urea
N-[2-(4-methoxyphenyl)ethyl]-N'-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-6-yl)urea
Compound characteristics
| Compound ID: | Y044-5391 |
| Compound Name: | N-[2-(4-methoxyphenyl)ethyl]-N'-(4-oxo-3,4-dihydro-1,2,3-benzotriazin-6-yl)urea |
| Molecular Weight: | 339.35 |
| Molecular Formula: | C17 H17 N5 O3 |
| Smiles: | COc1ccc(CCNC(Nc2ccc3c(c2)C(NN=N3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 1.9411 |
| logD: | 1.8429 |
| logSw: | -2.8919 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 91.047 |
| InChI Key: | KPAVFRGHDJZUOP-UHFFFAOYSA-N |