propan-2-yl N-{3-[(2-ethoxy-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}glycinate
Chemical Structure Depiction of
propan-2-yl N-{3-[(2-ethoxy-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}glycinate
propan-2-yl N-{3-[(2-ethoxy-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}glycinate
Compound characteristics
| Compound ID: | 3232-0088 |
| Compound Name: | propan-2-yl N-{3-[(2-ethoxy-2-oxoethyl)sulfanyl]-5-oxo-4,5-dihydro-1,2,4-triazin-6-yl}glycinate |
| Molecular Weight: | 330.36 |
| Molecular Formula: | C12 H18 N4 O5 S |
| Smiles: | CCOC(CSC1NC(C(NCC(=O)OC(C)C)=NN=1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.5231 |
| logD: | -0.8095 |
| logSw: | -1.9995 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 97.413 |
| InChI Key: | BTMWJMMBDIDCGN-UHFFFAOYSA-N |