N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,2,3-thiadiazole-4-carboxamide
Chemical Structure Depiction of
N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,2,3-thiadiazole-4-carboxamide
N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,2,3-thiadiazole-4-carboxamide
Compound characteristics
| Compound ID: | D519-0500 |
| Compound Name: | N-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,2,3-thiadiazole-4-carboxamide |
| Molecular Weight: | 316.34 |
| Molecular Formula: | C14 H12 N4 O3 S |
| Smiles: | [H]N(C(c1csnn1)=O)c1ccc2c(c1)N(CC=C)C(CO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.3593 |
| logD: | 1.3573 |
| logSw: | -2.4099 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.015 |
| InChI Key: | ONQNCBMQGZWRMK-UHFFFAOYSA-N |