2-(3-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Chemical Structure Depiction of
2-(3-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
2-(3-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide
Compound characteristics
| Compound ID: | G651-0341 |
| Compound Name: | 2-(3-fluorophenyl)-N-[3-(methylsulfanyl)phenyl]-3-oxo-1,4,8-triazaspiro[4.5]dec-1-ene-8-carboxamide |
| Molecular Weight: | 412.48 |
| Molecular Formula: | C21 H21 F N4 O2 S |
| Smiles: | CSc1cccc(c1)NC(N1CCC2(CC1)NC(C(c1cccc(c1)F)=N2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9999 |
| logD: | 2.96 |
| logSw: | -3.5885 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 59.058 |
| InChI Key: | BJRRPMPEIPIKBT-UHFFFAOYSA-N |