tert-butyl 4-[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Chemical Structure Depiction of
tert-butyl 4-[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
tert-butyl 4-[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | M184-0133 |
| Compound Name: | tert-butyl 4-[4-amino-5-(4-methylbenzene-1-sulfonyl)pyrimidin-2-yl]piperazine-1-carboxylate |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C20 H27 N5 O4 S |
| Smiles: | Cc1ccc(cc1)S(c1cnc(nc1N)N1CCN(CC1)C(=O)OC(C)(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.189 |
| logD: | 3.189 |
| logSw: | -3.4571 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.798 |
| InChI Key: | PAQDJEBPQPVAGW-UHFFFAOYSA-N |