3-benzyl-1-(cyclopropylmethyl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Chemical Structure Depiction of
3-benzyl-1-(cyclopropylmethyl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
3-benzyl-1-(cyclopropylmethyl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide
Compound characteristics
| Compound ID: | V001-4351 |
| Compound Name: | 3-benzyl-1-(cyclopropylmethyl)-N-(3-methylphenyl)-2-oxo-1,4,8-triazaspiro[4.5]decane-8-carbothioamide |
| Molecular Weight: | 448.63 |
| Molecular Formula: | C26 H32 N4 O S |
| Smiles: | Cc1cccc(c1)NC(N1CCC2(CC1)NC(Cc1ccccc1)C(N2CC1CC1)=O)=S |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5661 |
| logD: | 3.1906 |
| logSw: | -4.3977 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 39.821 |
| InChI Key: | ZDQGNRKFZLJBHT-QHCPKHFHSA-N |