2-(3-methylphenyl)-1,2,4-triazaspiro[4.6]undecan-3-one
Chemical Structure Depiction of
2-(3-methylphenyl)-1,2,4-triazaspiro[4.6]undecan-3-one
2-(3-methylphenyl)-1,2,4-triazaspiro[4.6]undecan-3-one
Compound characteristics
| Compound ID: | J063-0104 |
| Compound Name: | 2-(3-methylphenyl)-1,2,4-triazaspiro[4.6]undecan-3-one |
| Molecular Weight: | 259.35 |
| Molecular Formula: | C15 H21 N3 O |
| Smiles: | Cc1cccc(c1)N1C(NC2(CCCCCC2)N1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6348 |
| logD: | 3.6348 |
| logSw: | -3.7159 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 41.386 |
| InChI Key: | SKVPUWOGHBESHQ-UHFFFAOYSA-N |