N-cyclopropyl-N-({(3S)-3-methyl-4-[(thiophen-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
Chemical Structure Depiction of
N-cyclopropyl-N-({(3S)-3-methyl-4-[(thiophen-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
N-cyclopropyl-N-({(3S)-3-methyl-4-[(thiophen-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide
Compound characteristics
Compound ID: | S978-0706 |
Compound Name: | N-cyclopropyl-N-({(3S)-3-methyl-4-[(thiophen-2-yl)methyl]-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl}methyl)methanesulfonamide |
Molecular Weight: | 406.56 |
Molecular Formula: | C20 H26 N2 O3 S2 |
Smiles: | C[C@H]1COc2ccc(CN(C3CC3)S(C)(=O)=O)cc2CN1Cc1cccs1 |
Stereo: | ABSOLUTE |
logP: | 3.5551 |
logD: | 2.9193 |
logSw: | -3.6617 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 44.364 |
InChI Key: | QVAXPSXBCREJJT-OAHLLOKOSA-N |