methyl 2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxyphenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Chemical Structure Depiction of
methyl 2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxyphenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
methyl 2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxyphenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate
Compound characteristics
| Compound ID: | Y502-3265 |
| Compound Name: | methyl 2-{3-[(4-chloro-3-methylphenoxy)methyl]-4-methoxyphenyl}-9-methylthieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine-8-carboxylate |
| Molecular Weight: | 508.98 |
| Molecular Formula: | C25 H21 Cl N4 O4 S |
| Smiles: | Cc1cc(ccc1[Cl])OCc1cc(ccc1OC)c1nc2c3c(C)c(C(=O)OC)sc3ncn2n1 |
| Stereo: | ACHIRAL |
| logP: | 6.256 |
| logD: | 6.2519 |
| logSw: | -6.2811 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 67.151 |
| InChI Key: | BXQMDQGCQWAGBW-UHFFFAOYSA-N |