ethyl 4-amino-2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
ethyl 4-amino-2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0240 |
| Compound Name: | ethyl 4-amino-2-{[2-(tert-butylamino)-2-oxoethyl]sulfanyl}pyrimidine-5-carboxylate |
| Molecular Weight: | 312.39 |
| Molecular Formula: | C13 H20 N4 O3 S |
| Smiles: | CCOC(c1cnc(nc1N)SCC(NC(C)(C)C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6801 |
| logD: | 1.6801 |
| logSw: | -2.5642 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 82.799 |
| InChI Key: | LFGWKEGIKBZQJD-UHFFFAOYSA-N |