N,2-bis(4-methylphenyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Chemical Structure Depiction of
N,2-bis(4-methylphenyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
N,2-bis(4-methylphenyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide
Compound characteristics
| Compound ID: | E972-0326 |
| Compound Name: | N,2-bis(4-methylphenyl)-3-(propylsulfanyl)-1,4,8-triazaspiro[4.5]deca-1,3-diene-8-carboxamide |
| Molecular Weight: | 434.6 |
| Molecular Formula: | C25 H30 N4 O S |
| Smiles: | CCCSC1C(c2ccc(C)cc2)=NC2(CCN(CC2)C(Nc2ccc(C)cc2)=O)N=1 |
| Stereo: | ACHIRAL |
| logP: | 4.8668 |
| logD: | 4.8667 |
| logSw: | -4.4049 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.63 |
| InChI Key: | KSCVMKMJJJFUQN-UHFFFAOYSA-N |