N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Chemical Structure Depiction of
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetamide
Compound characteristics
| Compound ID: | C096-0249 |
| Compound Name: | N-[(2,3-dihydro-1,4-benzodioxin-2-yl)methyl]-2-[6-methyl-4-oxo-5-(piperidine-1-sulfonyl)thieno[2,3-d]pyrimidin-3(4H)-yl]acetamide |
| Molecular Weight: | 518.61 |
| Molecular Formula: | C23 H26 N4 O6 S2 |
| Smiles: | Cc1c(c2C(N(CC(NCC3COc4ccccc4O3)=O)C=Nc2s1)=O)S(N1CCCCC1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5444 |
| logD: | 1.5444 |
| logSw: | -2.4869 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 98.103 |
| InChI Key: | FNDSRJOMGLZXMF-INIZCTEOSA-N |