benzyl [(4-oxo-3-{6-oxo-6-[(2-phenylethyl)amino]hexyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Chemical Structure Depiction of
benzyl [(4-oxo-3-{6-oxo-6-[(2-phenylethyl)amino]hexyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
benzyl [(4-oxo-3-{6-oxo-6-[(2-phenylethyl)amino]hexyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate
Compound characteristics
| Compound ID: | K292-1194 |
| Compound Name: | benzyl [(4-oxo-3-{6-oxo-6-[(2-phenylethyl)amino]hexyl}-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl)sulfanyl]acetate |
| Molecular Weight: | 549.71 |
| Molecular Formula: | C29 H31 N3 O4 S2 |
| Smiles: | C(CCC(NCCc1ccccc1)=O)CCN1C(=Nc2ccsc2C1=O)SCC(=O)OCc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 4.5415 |
| logD: | 4.5415 |
| logSw: | -4.3445 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.615 |
| InChI Key: | QHTKJJYNNMHEFJ-UHFFFAOYSA-N |