2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
Chemical Structure Depiction of
2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | Y502-6642 |
| Compound Name: | 2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}-N-(4-methoxy-2-nitrophenyl)acetamide |
| Molecular Weight: | 430.87 |
| Molecular Formula: | C19 H15 Cl N4 O4 S |
| Smiles: | COc1ccc(c(c1)[N+]([O-])=O)NC(CSc1nccc(c2ccc(cc2)[Cl])n1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9129 |
| logD: | 4.889 |
| logSw: | -5.2281 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.496 |
| InChI Key: | YXNQSGMMLRTURE-UHFFFAOYSA-N |