2-chloro-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}benzamide
Chemical Structure Depiction of
2-chloro-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}benzamide
2-chloro-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}benzamide
Compound characteristics
| Compound ID: | D487-0164 |
| Compound Name: | 2-chloro-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}benzamide |
| Molecular Weight: | 439.92 |
| Molecular Formula: | C22 H18 Cl N3 O3 S |
| Smiles: | Cc1c(c2ccc3c(c2)N(CC=C)C(CO3)=O)nc(NC(c2ccccc2[Cl])=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.5766 |
| logD: | 4.5163 |
| logSw: | -4.6246 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.955 |
| InChI Key: | KYRIYDZLXRBGPF-UHFFFAOYSA-N |