3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Chemical Structure Depiction of
3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide
Compound characteristics
| Compound ID: | L860-0134 |
| Compound Name: | 3-{[2-(4-chloro-2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl}-N-(3-methylphenyl)[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide |
| Molecular Weight: | 495.99 |
| Molecular Formula: | C24 H22 Cl N5 O3 S |
| Smiles: | Cc1cccc(c1)NC(c1ccc2nnc(n2c1)SCC(Nc1cc(C)c(cc1OC)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6708 |
| logD: | 4.6689 |
| logSw: | -4.9039 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.225 |
| InChI Key: | HQIVJDKDMVBMQB-UHFFFAOYSA-N |