N-(3-chlorophenyl)-2-(ethylsulfanyl)-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
N-(3-chlorophenyl)-2-(ethylsulfanyl)-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
N-(3-chlorophenyl)-2-(ethylsulfanyl)-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0392 |
| Compound Name: | N-(3-chlorophenyl)-2-(ethylsulfanyl)-3-(4-methylphenyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide |
| Molecular Weight: | 440.99 |
| Molecular Formula: | C23 H25 Cl N4 O S |
| Smiles: | CCSC1C(c2ccc(C)cc2)=NC2(CCN(CC2)C(Nc2cccc(c2)[Cl])=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 4.9346 |
| logD: | 4.9346 |
| logSw: | -4.9298 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.63 |
| InChI Key: | DOYLFLFDLWFAMQ-UHFFFAOYSA-N |