N-(2-bromo-4-methylphenyl)-3-(2-{[(2-methoxyphenyl)methyl]amino}-2-oxoethyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Chemical Structure Depiction of
N-(2-bromo-4-methylphenyl)-3-(2-{[(2-methoxyphenyl)methyl]amino}-2-oxoethyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
N-(2-bromo-4-methylphenyl)-3-(2-{[(2-methoxyphenyl)methyl]amino}-2-oxoethyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide
Compound characteristics
| Compound ID: | K895-0352 |
| Compound Name: | N-(2-bromo-4-methylphenyl)-3-(2-{[(2-methoxyphenyl)methyl]amino}-2-oxoethyl)-5-methyl-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidine-6-carboxamide |
| Molecular Weight: | 555.45 |
| Molecular Formula: | C25 H23 Br N4 O4 S |
| Smiles: | Cc1ccc(c(c1)[Br])NC(c1c(C)c2C(N(CC(NCc3ccccc3OC)=O)C=Nc2s1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9813 |
| logD: | 3.9707 |
| logSw: | -4.213 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 80.737 |
| InChI Key: | QNBFAJAUWNWAGV-UHFFFAOYSA-N |