2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-8-(phenylmethanesulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Chemical Structure Depiction of
2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-8-(phenylmethanesulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-8-(phenylmethanesulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Compound characteristics
| Compound ID: | G022-0081 |
| Compound Name: | 2-(4-tert-butylphenyl)-3-(ethylsulfanyl)-8-(phenylmethanesulfonyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene |
| Molecular Weight: | 483.69 |
| Molecular Formula: | C26 H33 N3 O2 S2 |
| Smiles: | CCSC1C(c2ccc(cc2)C(C)(C)C)=NC2(CCN(CC2)S(Cc2ccccc2)(=O)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 5.3283 |
| logD: | 5.3283 |
| logSw: | -5.3646 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 48.766 |
| InChI Key: | QKFVFFOJRAPNOC-UHFFFAOYSA-N |