3,4-dimethoxy-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzamide
Chemical Structure Depiction of
3,4-dimethoxy-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzamide
3,4-dimethoxy-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzamide
Compound characteristics
| Compound ID: | D487-0122 |
| Compound Name: | 3,4-dimethoxy-N-{4-[3-oxo-4-(prop-2-en-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3-thiazol-2-yl}benzamide |
| Molecular Weight: | 451.5 |
| Molecular Formula: | C23 H21 N3 O5 S |
| Smiles: | COc1ccc(cc1OC)C(Nc1nc(cs1)c1ccc2c(c1)N(CC=C)C(CO2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6416 |
| logD: | 3.6415 |
| logSw: | -4.0692 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.445 |
| InChI Key: | DWNMVNBRHPMVOQ-UHFFFAOYSA-N |