4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]butanamide
Chemical Structure Depiction of
4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]butanamide
4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]butanamide
Compound characteristics
| Compound ID: | C604-0165 |
| Compound Name: | 4-[2-({2-[(3-methoxypropyl)amino]-2-oxoethyl}sulfanyl)-4-oxo[1]benzothieno[3,2-d]pyrimidin-3(4H)-yl]-N-[(oxolan-2-yl)methyl]butanamide |
| Molecular Weight: | 532.68 |
| Molecular Formula: | C25 H32 N4 O5 S2 |
| Smiles: | COCCCNC(CSC1=Nc2c3ccccc3sc2C(N1CCCC(NCC1CCCO1)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.0975 |
| logD: | 1.0975 |
| logSw: | -2.204 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.297 |
| InChI Key: | PWNFLKVHLOONQK-QGZVFWFLSA-N |