N-{7-[(4-bromophenyl)(hydroxy)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}thiophene-2-carboxamide
Chemical Structure Depiction of
N-{7-[(4-bromophenyl)(hydroxy)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}thiophene-2-carboxamide
N-{7-[(4-bromophenyl)(hydroxy)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}thiophene-2-carboxamide
Compound characteristics
| Compound ID: | 8016-8969 |
| Compound Name: | N-{7-[(4-bromophenyl)(hydroxy)methyl]-2,3-dihydro-1,4-benzodioxin-6-yl}thiophene-2-carboxamide |
| Molecular Weight: | 446.32 |
| Molecular Formula: | C20 H16 Br N O4 S |
| Smiles: | C1COc2cc(c(cc2O1)C(c1ccc(cc1)[Br])O)NC(c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2 |
| logD: | 3.1999 |
| logSw: | -3.2291 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.887 |
| InChI Key: | RDOQEAUOLCMCAN-IBGZPJMESA-N |