N-(3-acetylphenyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N-(3-acetylphenyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N-(3-acetylphenyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
Compound ID: | F119-0821 |
Compound Name: | N-(3-acetylphenyl)-4-[(4-methylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
Molecular Weight: | 414.46 |
Molecular Formula: | C25 H22 N2 O4 |
Smiles: | CC(c1cccc(c1)NC(c1ccc2c(c1)N(Cc1ccc(C)cc1)C(CO2)=O)=O)=O |
Stereo: | ACHIRAL |
logP: | 3.8446 |
logD: | 3.8442 |
logSw: | -4.0008 |
Hydrogen bond acceptors count: | 7 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 60.986 |
InChI Key: | XQNKDGKOHONMMO-UHFFFAOYSA-N |