8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0724 |
| Compound Name: | 8-(3-chloro-4-methylbenzene-1-sulfonyl)-3-(4-chlorophenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 452.36 |
| Molecular Formula: | C20 H19 Cl2 N3 O3 S |
| Smiles: | Cc1ccc(cc1[Cl])S(N1CCC2(CC1)NC(C(c1ccc(cc1)[Cl])=N2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1968 |
| logD: | 4.192 |
| logSw: | -4.528 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.3 |
| InChI Key: | ZBWDXRBBVGNXBG-UHFFFAOYSA-N |