N-{5-methyl-4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}pyridine-4-carboxamide
Chemical Structure Depiction of
N-{5-methyl-4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}pyridine-4-carboxamide
N-{5-methyl-4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}pyridine-4-carboxamide
Compound characteristics
| Compound ID: | D487-0180 |
| Compound Name: | N-{5-methyl-4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}pyridine-4-carboxamide |
| Molecular Weight: | 406.46 |
| Molecular Formula: | C21 H18 N4 O3 S |
| Smiles: | Cc1c(c2ccc3c(c2)N(CC=C)C(CO3)=O)nc(NC(c2ccncc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 2.8725 |
| logD: | 2.8344 |
| logSw: | -3.1964 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.383 |
| InChI Key: | DNDQUHMOZYLXOH-UHFFFAOYSA-N |