7-(3-chloro-4-methylphenyl)-2-(methylsulfanyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Chemical Structure Depiction of
7-(3-chloro-4-methylphenyl)-2-(methylsulfanyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
7-(3-chloro-4-methylphenyl)-2-(methylsulfanyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one
Compound characteristics
| Compound ID: | Y020-9632 |
| Compound Name: | 7-(3-chloro-4-methylphenyl)-2-(methylsulfanyl)pyrido[4,3-e][1,2,4]triazolo[5,1-c][1,2,4]triazin-6(7H)-one |
| Molecular Weight: | 358.81 |
| Molecular Formula: | C15 H11 Cl N6 O S |
| Smiles: | Cc1ccc(cc1[Cl])N1C=CC2=C(C1=O)N=Nc1nc(nn12)SC |
| Stereo: | ACHIRAL |
| logP: | 4.0032 |
| logD: | 4.0032 |
| logSw: | -4.3612 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 62.83 |
| InChI Key: | MABXHPGPANIQDR-UHFFFAOYSA-N |