N-(4-bromophenyl)-2-(3-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-2-(3-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
N-(4-bromophenyl)-2-(3-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Compound characteristics
| Compound ID: | G651-0357 |
| Compound Name: | N-(4-bromophenyl)-2-(3-fluorophenyl)-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide |
| Molecular Weight: | 445.29 |
| Molecular Formula: | C20 H18 Br F N4 O2 |
| Smiles: | C1CN(CCC12NC(C(c1cccc(c1)F)=N2)=O)C(Nc1ccc(cc1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.3729 |
| logD: | 3.333 |
| logSw: | -3.6863 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.058 |
| InChI Key: | XLOXXFBJUTZSQK-UHFFFAOYSA-N |