3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
Chemical Structure Depiction of
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide
Compound characteristics
| Compound ID: | F145-0669 |
| Compound Name: | 3-(7-tert-butyl-4-oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)-N-{3-[ethyl(3-methylphenyl)amino]propyl}propanamide |
| Molecular Weight: | 508.73 |
| Molecular Formula: | C29 H40 N4 O2 S |
| Smiles: | CCN(CCCNC(CCC1NC(c2c3CCC(Cc3sc2N=1)C(C)(C)C)=O)=O)c1cccc(C)c1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4531 |
| logD: | 5.4202 |
| logSw: | -5.3092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.026 |
| InChI Key: | QXOWTWZITDNHIO-HXUWFJFHSA-N |