N-cyclopropyl-N-{[(3S)-4-(cyclopropylacetyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl}methanesulfonamide
Chemical Structure Depiction of
N-cyclopropyl-N-{[(3S)-4-(cyclopropylacetyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl}methanesulfonamide
N-cyclopropyl-N-{[(3S)-4-(cyclopropylacetyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl}methanesulfonamide
Compound characteristics
| Compound ID: | S978-0659 |
| Compound Name: | N-cyclopropyl-N-{[(3S)-4-(cyclopropylacetyl)-3-methyl-2,3,4,5-tetrahydro-1,4-benzoxazepin-7-yl]methyl}methanesulfonamide |
| Molecular Weight: | 392.52 |
| Molecular Formula: | C20 H28 N2 O4 S |
| Smiles: | C[C@H]1COc2ccc(CN(C3CC3)S(C)(=O)=O)cc2CN1C(CC1CC1)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.8443 |
| logD: | 2.8443 |
| logSw: | -3.2754 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 56.092 |
| InChI Key: | ZIAZZWIREHJUDF-CQSZACIVSA-N |