8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0720 |
| Compound Name: | 8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-phenyl-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 417.91 |
| Molecular Formula: | C20 H20 Cl N3 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])S(N1CCC2(CC1)NC(C(c1ccccc1)=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.497 |
| logD: | 3.4923 |
| logSw: | -3.972 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.3 |
| InChI Key: | MKVFGOYFSJOVIH-UHFFFAOYSA-N |