N-(3,5-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-2H-1,3-benzodioxole-5-carboxamide
Chemical Structure Depiction of
N-(3,5-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-2H-1,3-benzodioxole-5-carboxamide
N-(3,5-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-2H-1,3-benzodioxole-5-carboxamide
Compound characteristics
| Compound ID: | C761-1510 |
| Compound Name: | N-(3,5-dimethylphenyl)-N-(1,1-dioxo-2,3-dihydro-1H-1lambda~6~-thiophen-3-yl)-2H-1,3-benzodioxole-5-carboxamide |
| Molecular Weight: | 385.44 |
| Molecular Formula: | C20 H19 N O5 S |
| Smiles: | Cc1cc(C)cc(c1)N(C1CS(C=C1)(=O)=O)C(c1ccc2c(c1)OCO2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.1004 |
| logD: | 3.1004 |
| logSw: | -3.2343 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 60.495 |
| InChI Key: | HIRFKHTURFWMBS-MRXNPFEDSA-N |