4-{[4-butyl-8-chloro-7-(2,6-dimethylphenoxy)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl]oxy}benzonitrile
Chemical Structure Depiction of
4-{[4-butyl-8-chloro-7-(2,6-dimethylphenoxy)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl]oxy}benzonitrile
4-{[4-butyl-8-chloro-7-(2,6-dimethylphenoxy)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl]oxy}benzonitrile
Compound characteristics
| Compound ID: | 8610-0118 |
| Compound Name: | 4-{[4-butyl-8-chloro-7-(2,6-dimethylphenoxy)-1,1-dioxo-1,2,3,4-tetrahydro-1lambda~6~-pyrido[4,3-b][1,4]thiazin-5-yl]oxy}benzonitrile |
| Molecular Weight: | 512.03 |
| Molecular Formula: | C26 H26 Cl N3 O4 S |
| Smiles: | CCCCN1CCS(c2c1c(nc(c2[Cl])Oc1c(C)cccc1C)Oc1ccc(C#N)cc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3448 |
| logD: | 6.3448 |
| logSw: | -6.4191 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 73.59 |
| InChI Key: | ITENBXBWWBIRPV-UHFFFAOYSA-N |