(3R)-3-methyl-N-(2-phenylethyl)-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
(3R)-3-methyl-N-(2-phenylethyl)-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
(3R)-3-methyl-N-(2-phenylethyl)-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | SC09-0335 |
| Compound Name: | (3R)-3-methyl-N-(2-phenylethyl)-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 388.47 |
| Molecular Formula: | C23 H24 N4 O2 |
| Smiles: | C[C@@H]1COc2ccc(cc2CN1C(NCCc1ccccc1)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 3.3766 |
| logD: | 3.3766 |
| logSw: | -3.5148 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.077 |
| InChI Key: | HQLVFLHAZKAZMJ-QGZVFWFLSA-N |