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}-3-phenylpropanamide
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}-3-phenylpropanamide
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}-3-phenylpropanamide
Compound characteristics
| Compound ID: | D487-0155 |
| 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}-3-phenylpropanamide |
| Molecular Weight: | 433.53 |
| Molecular Formula: | C24 H23 N3 O3 S |
| Smiles: | Cc1c(c2ccc3c(c2)N(CC=C)C(CO3)=O)nc(NC(CCc2ccccc2)=O)s1 |
| Stereo: | ACHIRAL |
| logP: | 4.3979 |
| logD: | 4.397 |
| logSw: | -4.3607 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.741 |
| InChI Key: | NKNVQDPZYDBCGX-UHFFFAOYSA-N |