2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)acetamide
Chemical Structure Depiction of
2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)acetamide
2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)acetamide
Compound characteristics
| Compound ID: | 8019-3769 |
| Compound Name: | 2-[(4-amino-6-oxo-1,6-dihydropyrimidin-2-yl)sulfanyl]-N-(5-benzyl-3-cyano-4-methyl-1H-pyrrol-2-yl)acetamide |
| Molecular Weight: | 394.45 |
| Molecular Formula: | C19 H18 N6 O2 S |
| Smiles: | Cc1c(C#N)c(NC(CSC2NC(C=C(N)N=2)=O)=O)[nH]c1Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 0.8928 |
| logD: | 0.8419 |
| logSw: | -2.0174 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 5 |
| Polar surface area: | 106.155 |
| InChI Key: | IOSVLPFKOPMLBN-UHFFFAOYSA-N |