6-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(4-methoxyphenyl)hexanamide
Chemical Structure Depiction of
6-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(4-methoxyphenyl)hexanamide
6-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(4-methoxyphenyl)hexanamide
Compound characteristics
| Compound ID: | K292-1236 |
| Compound Name: | 6-{2-[(2-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-2-oxoethyl)sulfanyl]-4-oxothieno[3,2-d]pyrimidin-3(4H)-yl}-N-(4-methoxyphenyl)hexanamide |
| Molecular Weight: | 568.76 |
| Molecular Formula: | C29 H36 N4 O4 S2 |
| Smiles: | COc1ccc(cc1)NC(CCCCCN1C(=Nc2ccsc2C1=O)SCC(NCCC1CCCCC=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3948 |
| logD: | 4.3948 |
| logSw: | -4.0066 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.966 |
| InChI Key: | CULYININWAWYGK-UHFFFAOYSA-N |