N-(4-methylphenyl)-1,1-dioxo-3-{[(oxolan-2-yl)methyl]amino}-1H-1-benzothiophene-2-carboxamide
Chemical Structure Depiction of
N-(4-methylphenyl)-1,1-dioxo-3-{[(oxolan-2-yl)methyl]amino}-1H-1-benzothiophene-2-carboxamide
N-(4-methylphenyl)-1,1-dioxo-3-{[(oxolan-2-yl)methyl]amino}-1H-1-benzothiophene-2-carboxamide
Compound characteristics
| Compound ID: | D531-0414 |
| Compound Name: | N-(4-methylphenyl)-1,1-dioxo-3-{[(oxolan-2-yl)methyl]amino}-1H-1-benzothiophene-2-carboxamide |
| Molecular Weight: | 398.48 |
| Molecular Formula: | C21 H22 N2 O4 S |
| Smiles: | Cc1ccc(cc1)NC(C1=C(c2ccccc2S1(=O)=O)NCC1CCCO1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4483 |
| logD: | 2.447 |
| logSw: | -2.9183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.684 |
| InChI Key: | AIASUIBJJUUDAE-MRXNPFEDSA-N |