1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]amino}-1-oxobutan-2-yl N-benzoylmethioninate
Chemical Structure Depiction of
1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]amino}-1-oxobutan-2-yl N-benzoylmethioninate
1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]amino}-1-oxobutan-2-yl N-benzoylmethioninate
Compound characteristics
| Compound ID: | 4571-0009 |
| Compound Name: | 1-{[5-(ethoxycarbonyl)-4-methyl-1,3-thiazol-2-yl]amino}-1-oxobutan-2-yl N-benzoylmethioninate |
| Molecular Weight: | 507.63 |
| Molecular Formula: | C23 H29 N3 O6 S2 |
| Smiles: | CCC(C(Nc1nc(C)c(C(=O)OCC)s1)=O)OC(C(CCSC)NC(c1ccccc1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.6639 |
| logD: | 3.5431 |
| logSw: | -3.8859 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 99.324 |
| InChI Key: | QFOSXILVUVZEBR-UHFFFAOYSA-N |