9-(butylsulfanyl)-7,11-bis(3-chlorophenyl)-2,4,8,10-tetraazaspiro[5.5]undec-8-ene-1,3,5-trione
Chemical Structure Depiction of
9-(butylsulfanyl)-7,11-bis(3-chlorophenyl)-2,4,8,10-tetraazaspiro[5.5]undec-8-ene-1,3,5-trione
9-(butylsulfanyl)-7,11-bis(3-chlorophenyl)-2,4,8,10-tetraazaspiro[5.5]undec-8-ene-1,3,5-trione
Compound characteristics
| Compound ID: | C202-0397 |
| Compound Name: | 9-(butylsulfanyl)-7,11-bis(3-chlorophenyl)-2,4,8,10-tetraazaspiro[5.5]undec-8-ene-1,3,5-trione |
| Molecular Weight: | 505.42 |
| Molecular Formula: | C23 H22 Cl2 N4 O3 S |
| Smiles: | CCCCSC1NC(c2cccc(c2)[Cl])C2(C(c3cccc(c3)[Cl])N=1)C(NC(NC2=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5524 |
| logD: | 5.2422 |
| logSw: | -5.8327 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 84.808 |
| InChI Key: | ZIEAAVFYSWMQIB-UHFFFAOYSA-N |