N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide
Compound characteristics
| Compound ID: | K256-0127 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(4-oxo-2-sulfanylidene-1,4-dihydropyrido[2,3-d]pyrimidin-3(2H)-yl)acetamide |
| Molecular Weight: | 370.38 |
| Molecular Formula: | C17 H14 N4 O4 S |
| Smiles: | C(c1ccc2c(c1)OCO2)NC(CN1C(c2cccnc2NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5965 |
| logD: | 1.5623 |
| logSw: | -2.8062 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.529 |
| InChI Key: | HTLPBTALWPEYLV-UHFFFAOYSA-N |