N-(2-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-(2-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
N-(2-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | Y508-7650 |
| Compound Name: | N-(2-{2-[(6-bromo-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}-2-oxoethyl)-4-methylbenzene-1-sulfonamide |
| Molecular Weight: | 454.3 |
| Molecular Formula: | C17 H16 Br N3 O5 S |
| Smiles: | Cc1ccc(cc1)S(NCC(N/N=C/c1cc2c(cc1[Br])OCO2)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2372 |
| logD: | 3.232 |
| logSw: | -3.5057 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 94.486 |
| InChI Key: | XPJYZQWKJFAXRD-UHFFFAOYSA-N |