N-(2H-1,3-benzodioxol-5-yl)-5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxamide
N-(2H-1,3-benzodioxol-5-yl)-5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | 8019-3578 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-chloro-2-(methanesulfonyl)pyrimidine-4-carboxamide |
| Molecular Weight: | 355.75 |
| Molecular Formula: | C13 H10 Cl N3 O5 S |
| Smiles: | CS(c1ncc(c(C(Nc2ccc3c(c2)OCO3)=O)n1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.5031 |
| logD: | 1.2864 |
| logSw: | -2.8091 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 89.607 |
| InChI Key: | ACSINRMTCVXVAI-UHFFFAOYSA-N |