3-amino-4-(4-bromophenyl)-N~5~-(2,4-dimethylphenyl)-6-methyl-N~2~-[(oxolan-2-yl)methyl]thieno[2,3-b]pyridine-2,5-dicarboxamide
Chemical Structure Depiction of
3-amino-4-(4-bromophenyl)-N~5~-(2,4-dimethylphenyl)-6-methyl-N~2~-[(oxolan-2-yl)methyl]thieno[2,3-b]pyridine-2,5-dicarboxamide
3-amino-4-(4-bromophenyl)-N~5~-(2,4-dimethylphenyl)-6-methyl-N~2~-[(oxolan-2-yl)methyl]thieno[2,3-b]pyridine-2,5-dicarboxamide
Compound characteristics
| Compound ID: | C200-0365 |
| Compound Name: | 3-amino-4-(4-bromophenyl)-N~5~-(2,4-dimethylphenyl)-6-methyl-N~2~-[(oxolan-2-yl)methyl]thieno[2,3-b]pyridine-2,5-dicarboxamide |
| Molecular Weight: | 593.54 |
| Molecular Formula: | C29 H29 Br N4 O3 S |
| Smiles: | Cc1ccc(c(C)c1)NC(c1c(c2ccc(cc2)[Br])c2c(c(C(NCC3CCCO3)=O)sc2nc1C)N)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.9233 |
| logD: | 5.9231 |
| logSw: | -5.7083 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 85.111 |
| InChI Key: | WCGXNXSIIQGVDC-HXUWFJFHSA-N |