2-phenyl-8-(phenylmethanesulfonyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Chemical Structure Depiction of
2-phenyl-8-(phenylmethanesulfonyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
2-phenyl-8-(phenylmethanesulfonyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Compound characteristics
| Compound ID: | G022-0082 |
| Compound Name: | 2-phenyl-8-(phenylmethanesulfonyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene |
| Molecular Weight: | 441.61 |
| Molecular Formula: | C23 H27 N3 O2 S2 |
| Smiles: | CCCSC1C(c2ccccc2)=NC2(CCN(CC2)S(Cc2ccccc2)(=O)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 3.6911 |
| logD: | 3.6911 |
| logSw: | -3.7998 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.766 |
| InChI Key: | WBBVEPXTYMPFQT-UHFFFAOYSA-N |