N-cyclopropyl-N-({(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
Chemical Structure Depiction of
N-cyclopropyl-N-({(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
N-cyclopropyl-N-({(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
Compound characteristics
| Compound ID: | S978-0652 |
| Compound Name: | N-cyclopropyl-N-({(3S)-4-[(6-methoxypyridin-2-yl)methyl]-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide |
| Molecular Weight: | 431.55 |
| Molecular Formula: | C22 H29 N3 O4 S |
| Smiles: | C[C@H]1COc2ccc(CN(C3CC3)S(C)(=O)=O)cc2CN1Cc1cccc(n1)OC |
| Stereo: | ABSOLUTE |
| logP: | 3.4527 |
| logD: | 1.9934 |
| logSw: | -3.7021 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 59.901 |
| InChI Key: | FKWRDOIGTZHPRV-MRXNPFEDSA-N |