N-(2,5-difluorophenyl)-2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
N-(2,5-difluorophenyl)-2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | C916-0446 |
| Compound Name: | N-(2,5-difluorophenyl)-2-{[3-(4-methoxyphenyl)-8-methyl-1,4,8-triazaspiro[4.5]deca-1,3-dien-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C23 H24 F2 N4 O2 S |
| Smiles: | CN1CCC2(CC1)N=C(C(=N2)SCC(Nc1cc(ccc1F)F)=O)c1ccc(cc1)OC |
| Stereo: | ACHIRAL |
| logP: | 2.961 |
| logD: | 0.4722 |
| logSw: | -3.631 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.553 |
| InChI Key: | RDECNHQGIWLKDS-UHFFFAOYSA-N |