N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | C200-3360 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-({6-oxo-5-[4-(propan-2-yl)benzene-1-sulfonyl]-1,6-dihydropyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 501.58 |
| Molecular Formula: | C23 H23 N3 O6 S2 |
| Smiles: | CC(C)c1ccc(cc1)S(C1=CN=C(NC1=O)SCC(Nc1ccc2c(c1)OCCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.3292 |
| logD: | 0.6875 |
| logSw: | -3.0649 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.963 |
| InChI Key: | FAYAHNACYAINBY-UHFFFAOYSA-N |