8-(5-chloro-2-methylbenzene-1-sulfonyl)-3-(3-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
8-(5-chloro-2-methylbenzene-1-sulfonyl)-3-(3-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
8-(5-chloro-2-methylbenzene-1-sulfonyl)-3-(3-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | G651-0786 |
| Compound Name: | 8-(5-chloro-2-methylbenzene-1-sulfonyl)-3-(3-methylphenyl)-1,4,8-triazaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 431.94 |
| Molecular Formula: | C21 H22 Cl N3 O3 S |
| Smiles: | Cc1cccc(c1)C1C(NC2(CCN(CC2)S(c2cc(ccc2C)[Cl])(=O)=O)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7844 |
| logD: | 3.7835 |
| logSw: | -4.2161 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.3 |
| InChI Key: | GZPPNSLLDVVFPZ-UHFFFAOYSA-N |