3-[2-(3-chloroanilino)-2-oxoethyl]-N-[4-(methylsulfanyl)phenyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
3-[2-(3-chloroanilino)-2-oxoethyl]-N-[4-(methylsulfanyl)phenyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide
3-[2-(3-chloroanilino)-2-oxoethyl]-N-[4-(methylsulfanyl)phenyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | V010-0416 |
| Compound Name: | 3-[2-(3-chloroanilino)-2-oxoethyl]-N-[4-(methylsulfanyl)phenyl]-4-oxo-1-phenyl-1,3,8-triazaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 564.11 |
| Molecular Formula: | C29 H30 Cl N5 O3 S |
| Smiles: | CSc1ccc(cc1)NC(N1CCC2(CC1)C(N(CC(Nc1cccc(c1)[Cl])=O)CN2c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.7045 |
| logD: | 5.7042 |
| logSw: | -5.7406 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 68.874 |
| InChI Key: | BYEMONSYUYRCTM-UHFFFAOYSA-N |