8-(4-tert-butylbenzene-1-sulfonyl)-2-(ethylsulfanyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Chemical Structure Depiction of
8-(4-tert-butylbenzene-1-sulfonyl)-2-(ethylsulfanyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
8-(4-tert-butylbenzene-1-sulfonyl)-2-(ethylsulfanyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene
Compound characteristics
Compound ID: | G022-0240 |
Compound Name: | 8-(4-tert-butylbenzene-1-sulfonyl)-2-(ethylsulfanyl)-3-(4-methoxyphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene |
Molecular Weight: | 499.69 |
Molecular Formula: | C26 H33 N3 O3 S2 |
Smiles: | CCSC1C(c2ccc(cc2)OC)=NC2(CCN(CC2)S(c2ccc(cc2)C(C)(C)C)(=O)=O)N=1 |
Stereo: | ACHIRAL |
logP: | 5.7113 |
logD: | 5.7113 |
logSw: | -5.5118 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 56.415 |
InChI Key: | JTEYLLDNSUAWHI-UHFFFAOYSA-N |