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}propanamide
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}propanamide
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}propanamide
Compound characteristics
Compound ID: | D487-0143 |
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}propanamide |
Molecular Weight: | 357.43 |
Molecular Formula: | C18 H19 N3 O3 S |
Smiles: | CCC(Nc1nc(c2ccc3c(c2)N(CC=C)C(CO3)=O)c(C)s1)=O |
Stereo: | ACHIRAL |
logP: | 2.8999 |
logD: | 2.8996 |
logSw: | -3.3376 |
Hydrogen bond acceptors count: | 6 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 58.013 |
InChI Key: | VOYQIAVPNFZPEV-UHFFFAOYSA-N |