N-(4-bromophenyl)-4-(methanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
N-(4-bromophenyl)-4-(methanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
N-(4-bromophenyl)-4-(methanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-0037 |
| Compound Name: | N-(4-bromophenyl)-4-(methanesulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 411.27 |
| Molecular Formula: | C16 H15 Br N2 O4 S |
| Smiles: | CS(N1CC(C(Nc2ccc(cc2)[Br])=O)Oc2ccccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8287 |
| logD: | 2.8278 |
| logSw: | -3.6773 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.246 |
| InChI Key: | ALDDMSYJFXGTQS-HNNXBMFYSA-N |