N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide
Compound characteristics
| Compound ID: | J098-0014 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-(methanesulfonyl)-2,3,4,5-tetrahydro-1,5-benzoxazepine-2-carboxamide |
| Molecular Weight: | 404.44 |
| Molecular Formula: | C19 H20 N2 O6 S |
| Smiles: | CS(N1CCC(C(Nc2ccc3c(c2)OCCO3)=O)Oc2ccccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2715 |
| logD: | 1.2714 |
| logSw: | -2.4619 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.467 |
| InChI Key: | JAHGZUOFZYVEIN-QGZVFWFLSA-N |