N-[(furan-2-yl)methyl]-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Chemical Structure Depiction of
N-[(furan-2-yl)methyl]-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
N-[(furan-2-yl)methyl]-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide
Compound characteristics
| Compound ID: | J014-2061 |
| Compound Name: | N-[(furan-2-yl)methyl]-7-methyl-4-(4-methylbenzene-1-sulfonyl)-3,4-dihydro-2H-1,4-benzoxazine-2-carboxamide |
| Molecular Weight: | 426.49 |
| Molecular Formula: | C22 H22 N2 O5 S |
| Smiles: | Cc1ccc(cc1)S(N1CC(C(NCc2ccco2)=O)Oc2cc(C)ccc12)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7743 |
| logD: | 3.7743 |
| logSw: | -3.9044 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.553 |
| InChI Key: | RDZJQCMKVIUFTR-OAQYLSRUSA-N |