(3S)-N-cyclopentyl-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Chemical Structure Depiction of
(3S)-N-cyclopentyl-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
(3S)-N-cyclopentyl-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide
Compound characteristics
| Compound ID: | SC09-0333 |
| Compound Name: | (3S)-N-cyclopentyl-3-methyl-7-(pyrimidin-5-yl)-2,3-dihydro-1,4-benzoxazepine-4(5H)-carboxamide |
| Molecular Weight: | 352.43 |
| Molecular Formula: | C20 H24 N4 O2 |
| Smiles: | C[C@H]1COc2ccc(cc2CN1C(NC1CCCC1)=O)c1cncnc1 |
| Stereo: | ABSOLUTE |
| logP: | 3.1032 |
| logD: | 3.1032 |
| logSw: | -3.1275 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.327 |
| InChI Key: | DNNFUPKJYKIBNW-AWEZNQCLSA-N |