N-benzyl-4-(1-methylcyclopropane-1-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Chemical Structure Depiction of
N-benzyl-4-(1-methylcyclopropane-1-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
N-benzyl-4-(1-methylcyclopropane-1-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide
Compound characteristics
| Compound ID: | M400-0237 |
| Compound Name: | N-benzyl-4-(1-methylcyclopropane-1-carbonyl)-2,3,4,5-tetrahydro-1,4-benzoxazepine-7-carboxamide |
| Molecular Weight: | 364.44 |
| Molecular Formula: | C22 H24 N2 O3 |
| Smiles: | CC1(CC1)C(N1CCOc2ccc(cc2C1)C(NCc1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6428 |
| logD: | 2.6428 |
| logSw: | -3.0813 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.767 |
| InChI Key: | NPKCBPUEHBCWIM-UHFFFAOYSA-N |