2-(butylsulfanyl)-8-(3,4-dimethoxybenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
Chemical Structure Depiction of
2-(butylsulfanyl)-8-(3,4-dimethoxybenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
2-(butylsulfanyl)-8-(3,4-dimethoxybenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene
Compound characteristics
| Compound ID: | G022-0340 |
| Compound Name: | 2-(butylsulfanyl)-8-(3,4-dimethoxybenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]deca-1,3-diene |
| Molecular Weight: | 501.67 |
| Molecular Formula: | C25 H31 N3 O4 S2 |
| Smiles: | CCCCSC1C(c2ccccc2)=NC2(CCN(CC2)S(c2ccc(c(c2)OC)OC)(=O)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 4.3822 |
| logD: | 4.3822 |
| logSw: | -4.2638 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 64.132 |
| InChI Key: | SZJPUQPCGLOYLK-UHFFFAOYSA-N |