N-(2,3-dimethylphenyl)-2-{[3-(4-fluorophenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,3-dimethylphenyl)-2-{[3-(4-fluorophenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
N-(2,3-dimethylphenyl)-2-{[3-(4-fluorophenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C916-0118 |
| Compound Name: | N-(2,3-dimethylphenyl)-2-{[3-(4-fluorophenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 438.57 |
| Molecular Formula: | C24 H27 F N4 O S |
| Smiles: | Cc1cccc(c1C)NC(CSC1C(c2ccc(cc2)F)=NC2(CCN(C)CC2)N=1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4709 |
| logD: | 0.9821 |
| logSw: | -3.7093 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.009 |
| InChI Key: | UQUMWZBDTRZANV-UHFFFAOYSA-N |