4-(3-acetylphenyl)-7-bromo-N-cyclopentyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide
Chemical Structure Depiction of
4-(3-acetylphenyl)-7-bromo-N-cyclopentyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide
4-(3-acetylphenyl)-7-bromo-N-cyclopentyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide
Compound characteristics
| Compound ID: | E993-0253 |
| Compound Name: | 4-(3-acetylphenyl)-7-bromo-N-cyclopentyl-3-oxo-2,3,4,5-tetrahydro-1,4-benzoxazepine-5-carboxamide |
| Molecular Weight: | 471.35 |
| Molecular Formula: | C23 H23 Br N2 O4 |
| Smiles: | CC(c1cccc(c1)N1C(C(NC2CCCC2)=O)c2cc(ccc2OCC1=O)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.6542 |
| logD: | 3.6542 |
| logSw: | -3.8779 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.701 |
| InChI Key: | KLIVQXPTQOACHR-JOCHJYFZSA-N |