N-(4-acetamidophenyl)-5-chloro-2-[(prop-2-en-1-yl)sulfanyl]pyrimidine-4-carboxamide
Chemical Structure Depiction of
N-(4-acetamidophenyl)-5-chloro-2-[(prop-2-en-1-yl)sulfanyl]pyrimidine-4-carboxamide
N-(4-acetamidophenyl)-5-chloro-2-[(prop-2-en-1-yl)sulfanyl]pyrimidine-4-carboxamide
Compound characteristics
| Compound ID: | D233-0148 |
| Compound Name: | N-(4-acetamidophenyl)-5-chloro-2-[(prop-2-en-1-yl)sulfanyl]pyrimidine-4-carboxamide |
| Molecular Weight: | 362.84 |
| Molecular Formula: | C16 H15 Cl N4 O2 S |
| Smiles: | [H]N(C(c1c(cnc(n1)SCC=C)[Cl])=O)c1ccc(cc1)NC(C)=O |
| Stereo: | ACHIRAL |
| logP: | 3.1981 |
| logD: | 3.1967 |
| logSw: | -3.4355 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.177 |
| InChI Key: | FWMLKQSVOKDPSA-UHFFFAOYSA-N |