N-[(4-tert-butylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Chemical Structure Depiction of
N-[(4-tert-butylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
N-[(4-tert-butylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide
Compound characteristics
| Compound ID: | 8016-9036 |
| Compound Name: | N-[(4-tert-butylphenyl)methyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxamide |
| Molecular Weight: | 338.4 |
| Molecular Formula: | C20 H22 N2 O3 |
| Smiles: | CC(C)(C)c1ccc(CNC(c2ccc3c(c2)NC(CO3)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.4741 |
| logD: | 3.4741 |
| logSw: | -3.5087 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.922 |
| InChI Key: | LTEMSSPLCZTGSU-UHFFFAOYSA-N |