methyl 4-[8-bromo-9-(methoxymethyl)-7-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate
Chemical Structure Depiction of
methyl 4-[8-bromo-9-(methoxymethyl)-7-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate
methyl 4-[8-bromo-9-(methoxymethyl)-7-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate
Compound characteristics
| Compound ID: | D369-0070 |
| Compound Name: | methyl 4-[8-bromo-9-(methoxymethyl)-7-methyl-4-oxopyrido[3',2':4,5]thieno[3,2-d][1,2,3]triazin-3(4H)-yl]benzoate |
| Molecular Weight: | 475.32 |
| Molecular Formula: | C19 H15 Br N4 O4 S |
| Smiles: | Cc1c(c(COC)c2c3c(C(N(c4ccc(cc4)C(=O)OC)N=N3)=O)sc2n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.4247 |
| logD: | 4.4247 |
| logSw: | -4.6582 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 77.157 |
| InChI Key: | DBXYUKLXJBMUDM-UHFFFAOYSA-N |