2-methyl-4-(methylsulfanyl)-N~1~-phenyl-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarboxamide
Chemical Structure Depiction of
2-methyl-4-(methylsulfanyl)-N~1~-phenyl-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarboxamide
2-methyl-4-(methylsulfanyl)-N~1~-phenyl-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarboxamide
Compound characteristics
| Compound ID: | 8012-5645 |
| Compound Name: | 2-methyl-4-(methylsulfanyl)-N~1~-phenyl-3-azaspiro[5.5]undeca-1,3-diene-1,5-dicarboxamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C20 H25 N3 O2 S |
| Smiles: | CC1=C(C(Nc2ccccc2)=O)C2(CCCCC2)C(C(=N1)SC)C(N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4538 |
| logD: | 2.4536 |
| logSw: | -2.8379 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 65.409 |
| InChI Key: | XOMMBHBSHKXHSS-INIZCTEOSA-N |