2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | F409-0105 |
| Compound Name: | 2-{[4-amino-5-(thiophene-2-sulfonyl)pyrimidin-2-yl]sulfanyl}-1-(4-methylpiperidin-1-yl)ethan-1-one |
| Molecular Weight: | 412.55 |
| Molecular Formula: | C16 H20 N4 O3 S3 |
| Smiles: | CC1CCN(CC1)C(CSc1ncc(c(N)n1)S(c1cccs1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8496 |
| logD: | 1.8496 |
| logSw: | -2.238 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 85.39 |
| InChI Key: | QQDXMGCPJATYBB-UHFFFAOYSA-N |