ethyl 4-amino-2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Chemical Structure Depiction of
ethyl 4-amino-2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
ethyl 4-amino-2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate
Compound characteristics
| Compound ID: | E726-0252 |
| Compound Name: | ethyl 4-amino-2-({2-[butyl(methyl)amino]-2-oxoethyl}sulfanyl)pyrimidine-5-carboxylate |
| Molecular Weight: | 326.42 |
| Molecular Formula: | C14 H22 N4 O3 S |
| Smiles: | CCCCN(C)C(CSc1ncc(C(=O)OCC)c(N)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.705 |
| logD: | 1.705 |
| logSw: | -2.3299 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 75.377 |
| InChI Key: | BNHRJWKJROERJW-UHFFFAOYSA-N |