ethyl 2-{2-[(6-amino-4-oxo-1-phenyl-1,4-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{2-[(6-amino-4-oxo-1-phenyl-1,4-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
ethyl 2-{2-[(6-amino-4-oxo-1-phenyl-1,4-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Compound characteristics
| Compound ID: | 4571-0023 |
| Compound Name: | ethyl 2-{2-[(6-amino-4-oxo-1-phenyl-1,4-dihydropyrimidin-2-yl)sulfanyl]acetamido}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate |
| Molecular Weight: | 484.6 |
| Molecular Formula: | C23 H24 N4 O4 S2 |
| Smiles: | CCOC(c1c2CCCCc2sc1NC(CSC1=NC(C=C(N)N1c1ccccc1)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9662 |
| logD: | 1.2259 |
| logSw: | -3.4978 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 87.82 |
| InChI Key: | LBBGVZBKCCUUOR-UHFFFAOYSA-N |