N-{3-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-{3-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-benzothiophene-2-carboxamide
N-{3-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | V004-4767 |
| Compound Name: | N-{3-[6-(3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl)pyridin-2-yl]phenyl}-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 477.54 |
| Molecular Formula: | C28 H19 N3 O3 S |
| Smiles: | C1C(Nc2cc(ccc2O1)c1cccc(c2cccc(c2)NC(c2cc3ccccc3s2)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.4699 |
| logD: | 6.4693 |
| logSw: | -6.9098 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.419 |
| InChI Key: | JYUDRWODRUULKD-UHFFFAOYSA-N |