8-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(methylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
Chemical Structure Depiction of
8-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(methylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
8-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(methylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
Compound characteristics
| Compound ID: | G022-0438 |
| Compound Name: | 8-(3-chloro-4-fluorobenzene-1-sulfonyl)-2-(methylsulfanyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene |
| Molecular Weight: | 451.97 |
| Molecular Formula: | C20 H19 Cl F N3 O2 S2 |
| Smiles: | CSC1C(c2ccccc2)=NC2(CCN(CC2)S(c2ccc(c(c2)[Cl])F)(=O)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 3.8886 |
| logD: | 3.8886 |
| logSw: | -4.3186 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.871 |
| InChI Key: | GXHFXFDKJWCZFN-UHFFFAOYSA-N |